#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k4t s ALA 2 N 0.00 2.76 -0.73 3.17 0.00 -1.26 -4.90 121.76 120.80 2k4t s ALA 2 Ca 0.00 -3.15 -0.01 0.00 0.00 0.00 0.00 51.96 48.81 2k4t s ALA 2 Cb 0.00 -1.95 -0.01 0.00 0.00 0.00 0.00 23.12 21.16 2k4t s ALA 2 CO 0.00 -2.05 0.68 0.28 0.00 0.00 0.00 175.76 174.67 2k4t n VAL 3 N 2.64 -9.57 -1.18 0.00 0.31 -1.26 -5.00 118.33 104.27 2k4t n VAL 3 Ca 0.19 -0.34 -0.29 0.00 -0.01 0.00 0.00 64.34 63.88 2k4t n VAL 3 Cb 0.38 -6.70 0.16 0.00 -0.91 0.00 0.00 33.84 26.77 2k4t n VAL 3 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 2k4t s PRO 4 N -3.14 0.74 0.26 5.55 0.04 -1.26 -4.97 135.00 132.22 2k4t s PRO 4 Ca 0.05 0.63 0.03 0.00 0.04 0.00 0.00 61.00 61.75 2k4t s PRO 4 Cb -0.01 -1.76 0.33 0.00 0.04 0.00 0.00 34.50 33.10 2k4t s PRO 4 CO 0.71 -2.55 1.63 -1.00 0.04 0.00 0.00 177.00 175.84 2k4t h PRO 5 N -1.76 0.35 -5.24 0.56 0.13 -2.05 -3.47 132.00 120.51 2k4t h PRO 5 Ca -0.53 -0.18 -0.36 0.00 -0.87 0.00 0.00 66.00 64.06 2k4t h PRO 5 Cb 1.31 0.01 -0.07 0.00 0.13 0.00 0.00 31.00 32.38 2k4t h PRO 5 CO 0.56 0.73 -0.52 0.25 -0.23 0.00 0.00 178.00 178.79 2k4t n THR 6 N -4.00 -0.97 -0.08 1.56 -2.24 -1.26 -4.83 114.28 102.46 2k4t n THR 6 Ca -0.02 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.69 2k4t n THR 6 Cb 0.52 -1.85 0.09 0.00 -2.10 0.00 0.00 70.33 67.00 2k4t n THR 6 CO 0.00 0.00 0.00 0.10 -0.57 0.00 0.00 175.07 174.60 2k4t h TYR 7 N -0.87 0.85 0.00 4.78 -0.00 -1.98 -2.55 116.97 117.20 2k4t h TYR 7 Ca -0.41 -0.20 0.00 0.00 -0.00 0.00 0.00 58.73 58.12 2k4t h TYR 7 Cb 1.28 -0.20 0.00 0.00 -0.00 0.00 0.00 36.73 37.81 2k4t h TYR 7 CO 0.67 0.91 0.00 0.00 -0.00 0.00 0.00 178.16 179.74 2k4t h ALA 8 N 1.08 1.00 0.00 0.10 0.00 -1.96 -3.12 119.26 116.37 2k4t h ALA 8 Ca 0.09 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.89 2k4t h ALA 8 Cb 0.74 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 2k4t h ALA 8 CO 0.06 0.00 -0.65 -0.44 0.00 0.00 0.00 179.25 178.22 2k4t h ASP 9 N 0.00 0.00 -0.27 0.00 5.19 -1.76 -3.25 116.42 116.33 2k4t h ASP 9 Ca 0.00 0.00 0.08 0.00 -0.62 0.00 0.00 57.03 56.49 2k4t h ASP 9 Cb 0.70 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.20 2k4t h ASP 9 CO 0.00 0.47 0.29 -0.07 -3.12 0.00 0.00 179.24 176.81 2k4t h LEU 10 N 0.00 0.00 0.00 1.55 4.07 -1.44 -3.32 115.31 116.17 2k4t h LEU 10 Ca -0.03 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.93 2k4t h LEU 10 Cb 1.38 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.12 2k4t h LEU 10 CO 0.06 0.00 0.00 0.61 -1.08 0.00 0.00 178.44 178.03 2k4t n GLY 11 N -1.45 -0.40 3.52 0.83 0.00 -1.23 -4.41 105.19 102.05 2k4t n GLY 11 Ca 0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.68 2k4t n GLY 11 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2k4t n LYS 12 N -1.78 0.58 -2.84 1.61 2.85 -1.23 -4.66 118.16 112.70 2k4t n LYS 12 Ca 0.00 0.23 -0.07 0.00 -1.05 0.00 0.00 58.31 57.42 2k4t n LYS 12 Cb 0.00 -1.91 0.00 0.00 -0.65 0.00 0.00 35.03 32.47 2k4t n LYS 12 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 177.40 177.78 2k4t n SER 13 N -0.21 -1.13 -4.25 -5.58 7.64 -1.26 -4.76 113.62 104.07 2k4t n SER 13 Ca 0.12 -2.05 -0.16 0.00 1.01 0.00 0.00 58.87 57.78 2k4t n SER 13 Cb 0.48 1.96 -0.11 0.00 -1.01 0.00 0.00 64.21 65.53 2k4t n SER 13 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k4t s ALA 14 N -1.96 1.48 0.01 -0.43 0.00 -1.26 -5.16 121.76 114.44 2k4t s ALA 14 Ca 0.13 -1.37 -0.03 0.00 0.00 0.00 0.00 51.96 50.69 2k4t s ALA 14 Cb -0.02 -0.03 -0.01 0.00 0.00 0.00 0.00 23.12 23.06 2k4t s ALA 14 CO 0.10 0.02 0.04 1.03 0.00 0.00 0.00 175.76 176.95 2k4t s ARG 15 N -3.10 0.36 0.31 0.00 0.52 -1.26 -5.17 118.95 110.61 2k4t s ARG 15 Ca 0.12 -0.48 -0.18 0.00 -0.52 0.00 0.00 55.73 54.67 2k4t s ARG 15 Cb -0.02 0.14 0.06 0.00 0.52 0.00 0.00 34.95 35.65 2k4t s ARG 15 CO 0.02 -0.07 0.88 0.16 0.02 0.00 0.00 175.30 176.31 2k4t s ASP 16 N -1.32 -0.01 -0.28 0.23 -4.77 -1.26 -5.18 116.67 104.08 2k4t s ASP 16 Ca -0.14 -0.95 -0.18 0.00 -3.30 0.00 0.00 52.55 47.99 2k4t s ASP 16 Cb -0.08 0.71 0.12 0.00 -1.09 0.00 0.00 42.92 42.58 2k4t s ASP 16 CO 0.00 -1.41 0.89 0.54 0.70 0.00 0.00 175.17 175.89 2k4t s VAL 17 N -2.33 0.00 -0.22 2.11 0.11 -1.26 -5.18 120.40 113.64 2k4t s VAL 17 Ca 0.17 0.00 -0.30 0.00 -2.93 0.00 0.00 61.98 58.93 2k4t s VAL 17 Cb -0.04 -1.00 0.16 0.00 -1.53 0.00 0.00 36.38 33.97 2k4t s VAL 17 CO 0.09 0.00 1.17 0.72 -3.33 0.00 0.00 175.10 173.75 2k4t s PHE 18 N 1.24 -0.21 -0.45 1.54 -0.71 -1.26 -5.10 117.98 113.03 2k4t s PHE 18 Ca -0.07 0.35 0.08 0.00 -1.04 0.00 0.00 56.93 56.25 2k4t s PHE 18 Cb -0.04 0.47 0.28 0.00 -1.21 0.00 0.00 43.02 42.52 2k4t s PHE 18 CO -0.15 -0.20 0.64 2.41 -1.34 0.00 0.00 175.22 176.59 2k4t n THR 19 N 0.60 0.34 -3.81 -4.49 -1.04 -1.26 -5.08 114.28 99.55 2k4t n THR 19 Ca -0.05 -4.50 -0.13 0.00 -2.04 0.00 0.00 64.05 57.33 2k4t n THR 19 Cb 0.58 -1.61 -0.14 0.00 -1.82 0.00 0.00 70.33 67.35 2k4t n THR 19 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 2k4t s LYS 20 N -1.88 0.10 0.00 -2.82 -0.14 -1.26 -5.06 119.74 108.67 2k4t s LYS 20 Ca 0.38 0.19 0.00 0.00 -1.36 0.00 0.00 55.97 55.18 2k4t s LYS 20 Cb 0.21 -0.02 0.00 0.00 -1.68 0.00 0.00 37.83 36.34 2k4t s LYS 20 CO -0.09 -0.06 0.00 0.41 -0.76 0.00 0.00 175.35 174.86 2k4t n GLY 21 N 3.37 0.27 3.40 -3.33 0.00 -1.26 -5.15 105.19 102.49 2k4t n GLY 21 Ca -0.16 -0.87 0.02 0.00 0.00 0.00 0.00 46.02 45.00 2k4t n GLY 21 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2k4t s TYR 22 N 0.00 -0.37 0.00 1.61 5.04 -1.26 -5.18 117.35 117.19 2k4t s TYR 22 Ca 0.00 0.66 0.00 0.00 -2.44 0.00 0.00 57.07 55.29 2k4t s TYR 22 Cb 0.00 0.22 0.00 0.00 0.35 0.00 0.00 41.96 42.53 2k4t s TYR 22 CO 0.00 -0.18 0.00 0.41 -1.34 0.00 0.00 175.55 174.44 2k4t n GLY 23 N 4.36 0.25 3.73 8.97 0.00 -1.26 -4.92 105.19 116.32 2k4t n GLY 23 Ca -0.11 -0.88 -0.42 0.00 0.00 0.00 0.00 46.02 44.62 2k4t n GLY 23 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2k4t s PHE 24 N -2.00 3.19 0.20 1.61 2.19 -1.26 -4.65 117.98 117.26 2k4t s PHE 24 Ca 0.00 1.02 0.00 0.00 0.33 0.00 0.00 56.93 58.28 2k4t s PHE 24 Cb 0.00 -3.70 0.00 0.00 -1.31 0.00 0.00 43.02 38.01 2k4t s PHE 24 CO 0.00 -2.37 0.00 0.41 1.83 0.00 0.00 175.22 175.09 2k4t n GLY 25 N 2.91 -4.50 3.08 13.12 0.00 -1.26 -1.96 105.19 116.59 2k4t n GLY 25 Ca 0.09 -0.58 -0.25 0.00 0.00 0.00 0.00 46.02 45.28 2k4t n GLY 25 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2k4t s LEU 26 N -1.22 1.80 -0.25 0.99 2.96 -0.06 -2.96 118.68 119.94 2k4t s LEU 26 Ca 0.00 -0.33 0.02 0.00 -0.22 0.00 0.00 54.13 53.60 2k4t s LEU 26 Cb 0.00 -0.89 0.06 0.00 0.50 0.00 0.00 46.19 45.86 2k4t s LEU 26 CO 0.00 0.09 -0.06 -0.63 -1.32 0.00 0.00 176.35 174.43 2k4t s ILE 27 N 0.33 1.76 -0.15 6.68 -1.09 0.33 -0.95 121.20 128.10 2k4t s ILE 27 Ca -0.09 -1.41 -0.07 0.00 -2.23 0.00 0.00 60.65 56.85 2k4t s ILE 27 Cb -0.13 -1.99 -0.04 0.00 -1.58 0.00 0.00 42.46 38.72 2k4t s ILE 27 CO 0.03 -0.11 0.09 -0.54 -1.23 0.00 0.00 174.94 173.19 2k4t s LYS 28 N 1.28 3.74 -0.13 2.79 -0.14 -0.02 -0.93 119.74 126.33 2k4t s LYS 28 Ca -0.06 -0.26 0.00 0.00 -1.36 0.00 0.00 55.97 54.30 2k4t s LYS 28 Cb -0.19 -3.20 0.02 0.00 -1.68 0.00 0.00 37.83 32.78 2k4t s LYS 28 CO -0.06 0.49 -0.12 -0.51 -0.76 0.00 0.00 175.35 174.39 2k4t s LEU 29 N -0.22 1.54 -0.13 3.17 1.02 0.61 -1.09 118.68 123.58 2k4t s LEU 29 Ca 0.09 -0.43 0.01 0.00 0.02 0.00 0.00 54.13 53.83 2k4t s LEU 29 Cb -0.12 -1.07 -0.00 0.00 0.02 0.00 0.00 46.19 45.02 2k4t s LEU 29 CO 0.01 -0.07 -0.18 -1.81 0.02 0.00 0.00 176.35 174.33 2k4t s ASP 30 N 1.50 3.55 0.04 2.29 1.11 -0.56 -1.11 116.67 123.49 2k4t s ASP 30 Ca 0.04 -0.47 0.06 0.00 0.18 0.00 0.00 52.55 52.36 2k4t s ASP 30 Cb -0.13 -1.52 -0.02 0.00 1.07 0.00 0.00 42.92 42.31 2k4t s ASP 30 CO -0.09 0.13 -0.17 -0.76 1.18 0.00 0.00 175.17 175.45 2k4t s LEU 31 N 0.56 2.17 -0.05 1.23 1.02 -0.49 -4.29 118.68 118.82 2k4t s LEU 31 Ca -0.11 -0.49 -0.02 0.00 0.02 0.00 0.00 54.13 53.53 2k4t s LEU 31 Cb -0.16 -0.79 0.03 0.00 0.02 0.00 0.00 46.19 45.28 2k4t s LEU 31 CO 0.04 0.10 0.05 -0.75 0.02 0.00 0.00 176.35 175.81 2k4t s LYS 32 N -1.15 0.07 0.15 1.70 2.20 -1.26 -1.17 119.74 120.28 2k4t s LYS 32 Ca 0.05 0.30 0.05 0.00 -0.36 0.00 0.00 55.97 56.00 2k4t s LYS 32 Cb -0.08 -0.67 -0.04 0.00 -1.51 0.00 0.00 37.83 35.52 2k4t s LYS 32 CO 0.02 -0.34 -0.11 -0.08 -0.36 0.00 0.00 175.35 174.47 2k4t s THR 33 N 2.13 1.24 -0.10 3.43 -1.32 0.30 -3.95 115.64 117.36 2k4t s THR 33 Ca 0.05 -2.02 -0.03 0.00 -1.21 0.00 0.00 61.69 58.48 2k4t s THR 33 Cb -0.12 -1.81 -0.03 0.00 -1.51 0.00 0.00 72.50 69.02 2k4t s THR 33 CO -0.04 -0.69 0.01 -1.59 -2.21 0.00 0.00 174.62 170.10 2k4t s LYS 34 N -3.58 3.15 -0.02 7.08 0.00 -1.26 -0.08 119.74 125.02 2k4t s LYS 34 Ca 0.16 -0.40 0.03 0.00 0.00 0.00 0.00 55.97 55.76 2k4t s LYS 34 Cb 0.01 -2.86 -0.00 0.00 0.00 0.00 0.00 37.83 34.99 2k4t s LYS 34 CO 0.01 0.63 -0.09 0.45 0.00 0.00 0.00 175.35 176.35 2k4t s SER 35 N -0.68 1.20 -2.01 0.03 0.15 -1.06 -4.74 113.70 106.59 2k4t s SER 35 Ca 0.11 -0.19 0.00 0.00 0.70 0.00 0.00 55.95 56.57 2k4t s SER 35 Cb -0.12 -0.25 0.00 0.00 -1.71 0.00 0.00 66.02 63.95 2k4t s SER 35 CO 0.02 0.09 0.00 1.21 1.20 0.00 0.00 173.24 175.76 2k4t n GLU 36 N 3.11 -1.41 -2.43 5.44 4.07 -1.26 -2.01 120.64 126.15 2k4t n GLU 36 Ca -0.16 1.17 -0.12 0.00 -0.06 0.00 0.00 57.16 57.98 2k4t n GLU 36 Cb 0.55 -5.51 -0.01 0.00 -0.06 0.00 0.00 31.44 26.41 2k4t n GLU 36 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 2k4t n ASN 37 N -1.20 -3.89 0.00 4.31 4.13 -1.26 -4.70 115.26 112.64 2k4t n ASN 37 Ca -0.19 0.20 0.00 0.00 1.68 0.00 0.00 54.58 56.27 2k4t n ASN 37 Cb 0.65 -3.31 0.00 0.00 -1.54 0.00 0.00 39.78 35.57 2k4t n ASN 37 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2k4t n GLY 38 N -0.80 -0.07 3.71 7.41 0.00 -0.85 -5.13 105.19 109.46 2k4t n GLY 38 Ca -0.15 0.03 -0.31 0.00 0.00 0.00 0.00 46.02 45.59 2k4t n GLY 38 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2k4t s LEU 39 N -1.57 2.70 -0.09 0.99 2.34 -1.17 -4.62 118.68 117.25 2k4t s LEU 39 Ca 0.00 1.90 0.03 0.00 0.06 0.00 0.00 54.13 56.12 2k4t s LEU 39 Cb 0.00 -4.38 -0.01 0.00 -0.56 0.00 0.00 46.19 41.24 2k4t s LEU 39 CO 0.00 -2.69 -0.19 -1.61 -1.06 0.00 0.00 176.35 170.80 2k4t s GLU 40 N -4.78 2.97 -0.35 1.48 2.02 0.93 -2.55 118.70 118.42 2k4t s GLU 40 Ca 0.64 -0.79 -0.11 0.00 0.02 0.00 0.00 54.97 54.74 2k4t s GLU 40 Cb -0.20 -2.40 0.01 0.00 0.10 0.00 0.00 34.13 31.65 2k4t s GLU 40 CO 0.57 0.30 0.19 -0.06 0.02 0.00 0.00 175.26 176.29 2k4t s PHE 41 N 0.07 3.22 -0.11 1.61 0.08 0.88 -1.69 117.98 122.04 2k4t s PHE 41 Ca -0.08 -0.77 0.01 0.00 0.12 0.00 0.00 56.93 56.21 2k4t s PHE 41 Cb -0.15 -2.41 -0.02 0.00 -0.57 0.00 0.00 43.02 39.87 2k4t s PHE 41 CO 0.05 -0.56 -0.15 0.99 -0.10 0.00 0.00 175.22 175.46 2k4t s THR 42 N 1.58 2.93 0.04 0.64 2.01 -0.51 -0.54 115.64 121.79 2k4t s THR 42 Ca 0.03 -0.72 0.09 0.00 0.31 0.00 0.00 61.69 61.40 2k4t s THR 42 Cb -0.18 -2.20 -0.03 0.00 0.01 0.00 0.00 72.50 70.10 2k4t s THR 42 CO 0.07 0.54 -0.26 -0.55 -0.69 0.00 0.00 174.62 173.73 2k4t s SER 43 N 0.10 3.23 -0.07 3.53 0.15 -0.32 -1.28 113.70 119.04 2k4t s SER 43 Ca -0.07 -0.58 -0.00 0.00 0.70 0.00 0.00 55.95 56.01 2k4t s SER 43 Cb -0.15 -0.32 0.02 0.00 -1.71 0.00 0.00 66.02 63.86 2k4t s SER 43 CO 0.05 0.26 -0.04 -0.94 1.20 0.00 0.00 173.24 173.76 2k4t s SER 44 N -1.26 1.58 0.01 5.45 1.04 -0.52 -1.39 113.70 118.60 2k4t s SER 44 Ca 0.12 -0.17 0.05 0.00 0.48 0.00 0.00 55.95 56.43 2k4t s SER 44 Cb -0.10 -0.59 -0.02 0.00 0.10 0.00 0.00 66.02 65.42 2k4t s SER 44 CO 0.02 -0.11 -0.15 -0.83 0.98 0.00 0.00 173.24 173.15 2k4t s GLY 45 N 1.47 0.79 -0.03 7.32 0.00 -0.26 -0.14 107.32 116.47 2k4t s GLY 45 Ca -0.02 -0.74 0.03 0.00 0.00 0.00 0.00 44.72 44.00 2k4t s GLY 45 CO -0.04 -0.65 -0.13 -1.35 0.00 0.00 0.00 173.10 170.93 2k4t s SER 46 N -0.64 1.72 -0.02 1.64 1.04 0.44 -0.28 113.70 117.60 2k4t s SER 46 Ca 0.05 -0.28 0.02 0.00 0.48 0.00 0.00 55.95 56.23 2k4t s SER 46 Cb -0.07 -0.46 0.00 0.00 0.10 0.00 0.00 66.02 65.59 2k4t s SER 46 CO 0.00 0.11 -0.08 0.00 0.98 0.00 0.00 173.24 174.25 2k4t s ALA 47 N 0.10 0.79 0.01 5.32 0.00 -0.11 -0.98 121.76 126.88 2k4t s ALA 47 Ca -0.03 -0.30 0.08 0.00 0.00 0.00 0.00 51.96 51.71 2k4t s ALA 47 Cb -0.10 -0.29 -0.02 0.00 0.00 0.00 0.00 23.12 22.70 2k4t s ALA 47 CO 0.01 0.13 -0.25 -0.80 0.00 0.00 0.00 175.76 174.85 2k4t s ASN 48 N 0.18 3.22 -0.47 0.00 0.01 -1.26 -0.51 114.94 116.11 2k4t s ASN 48 Ca -0.03 -0.49 -0.02 0.00 -0.71 0.00 0.00 52.86 51.62 2k4t s ASN 48 Cb -0.08 -0.38 0.29 0.00 0.41 0.00 0.00 41.25 41.49 2k4t s ASN 48 CO 0.00 0.30 2.08 0.35 -1.51 0.00 0.00 177.10 178.32 2k4t n THR 49 N 2.13 3.14 0.04 1.60 -2.24 -0.83 -4.23 114.28 113.89 2k4t n THR 49 Ca -0.16 -2.28 0.00 0.00 -2.27 0.00 0.00 64.05 59.33 2k4t n THR 49 Cb 0.51 -1.29 0.00 0.00 -2.10 0.00 0.00 70.33 67.45 2k4t n THR 49 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 2k4t n GLU 50 N -0.08 0.00 -4.28 -0.78 0.00 -1.25 -4.67 120.64 109.58 2k4t n GLU 50 Ca 0.44 0.00 -0.16 0.00 0.00 0.00 0.00 57.16 57.44 2k4t n GLU 50 Cb 0.59 -0.34 -0.10 0.00 0.00 0.00 0.00 31.44 31.59 2k4t n GLU 50 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.13 178.12 2k4t s THR 51 N -2.00 1.36 -1.18 6.31 2.01 -1.26 -5.02 115.64 115.86 2k4t s THR 51 Ca 0.00 -2.11 -0.17 0.00 0.31 0.00 0.00 61.69 59.72 2k4t s THR 51 Cb 0.00 -1.91 -0.04 0.00 0.01 0.00 0.00 72.50 70.56 2k4t s THR 51 CO 0.00 -0.69 2.10 0.41 -0.69 0.00 0.00 174.62 175.74 2k4t n THR 52 N -0.25 2.80 -3.59 -0.82 -1.04 -1.26 -4.71 114.28 105.41 2k4t n THR 52 Ca -0.10 -2.46 -0.29 0.00 -2.04 0.00 0.00 64.05 59.16 2k4t n THR 52 Cb 0.60 -2.48 -0.14 0.00 -1.82 0.00 0.00 70.33 66.49 2k4t n THR 52 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 2k4t s LYS 53 N 3.98 0.56 -0.24 -2.82 -0.14 -1.26 -5.11 119.74 114.70 2k4t s LYS 53 Ca 0.52 -1.07 -0.11 0.00 -1.36 0.00 0.00 55.97 53.95 2k4t s LYS 53 Cb 0.14 -1.56 -0.05 0.00 -1.68 0.00 0.00 37.83 34.68 2k4t s LYS 53 CO -0.00 -1.08 0.17 0.08 -0.76 0.00 0.00 175.35 173.76 2k4t s VAL 54 N 1.49 5.36 -0.04 3.17 1.01 -1.26 -4.37 120.40 125.75 2k4t s VAL 54 Ca 0.13 0.20 -0.05 0.00 0.00 0.00 0.00 61.98 62.25 2k4t s VAL 54 Cb -0.19 -3.51 -0.04 0.00 0.00 0.00 0.00 36.38 32.64 2k4t s VAL 54 CO -0.19 0.35 0.19 -0.89 0.00 0.00 0.00 175.10 174.56 2k4t s THR 55 N 1.05 5.42 -0.29 3.92 2.01 -0.16 -4.96 115.64 122.63 2k4t s THR 55 Ca 0.08 0.06 0.03 0.00 0.31 0.00 0.00 61.69 62.17 2k4t s THR 55 Cb -0.13 -3.51 0.17 0.00 0.01 0.00 0.00 72.50 69.04 2k4t s THR 55 CO 0.04 0.44 0.47 -0.83 -0.69 0.00 0.00 174.62 174.05 2k4t s GLY 56 N -1.56 -0.81 0.28 4.40 0.00 -1.26 -0.42 107.32 107.94 2k4t s GLY 56 Ca 0.23 0.57 0.07 0.00 0.00 0.00 0.00 44.72 45.59 2k4t s GLY 56 CO 0.13 3.26 0.31 -1.35 0.00 0.00 0.00 173.10 175.45 2k4t s SER 57 N 2.65 5.76 0.00 1.64 1.04 0.80 -4.72 113.70 120.87 2k4t s SER 57 Ca 0.10 -0.21 0.02 0.00 0.48 0.00 0.00 55.95 56.34 2k4t s SER 57 Cb -0.12 -1.41 -0.01 0.00 0.10 0.00 0.00 66.02 64.59 2k4t s SER 57 CO -0.28 -0.18 -0.05 -0.22 0.98 0.00 0.00 173.24 173.49 2k4t s LEU 58 N -3.97 2.05 -0.03 2.42 1.98 -0.65 -1.43 118.68 119.05 2k4t s LEU 58 Ca 0.37 -0.16 -0.00 0.00 -2.89 0.00 0.00 54.13 51.45 2k4t s LEU 58 Cb -0.08 -0.24 0.03 0.00 0.66 0.00 0.00 46.19 46.57 2k4t s LEU 58 CO 0.27 0.02 0.04 -1.83 -1.89 0.00 0.00 176.35 172.97 2k4t s GLU 59 N -0.33 -0.02 -0.11 1.98 -1.05 -0.40 -1.97 118.70 116.79 2k4t s GLU 59 Ca 0.00 0.21 0.03 0.00 -0.15 0.00 0.00 54.97 55.06 2k4t s GLU 59 Cb -0.03 -0.24 -0.00 0.00 -0.44 0.00 0.00 34.13 33.42 2k4t s GLU 59 CO -0.00 -0.17 -0.21 0.99 0.95 0.00 0.00 175.26 176.82 2k4t s THR 60 N 1.09 2.27 -0.14 1.83 2.01 -1.05 -1.43 115.64 120.22 2k4t s THR 60 Ca -0.09 -0.94 0.01 0.00 0.31 0.00 0.00 61.69 60.98 2k4t s THR 60 Cb -0.13 -1.89 -0.01 0.00 0.01 0.00 0.00 72.50 70.48 2k4t s THR 60 CO -0.03 0.55 -0.16 -0.54 -0.69 0.00 0.00 174.62 173.74 2k4t s LYS 61 N 0.44 3.24 -0.10 4.92 1.02 -0.68 -0.91 119.74 127.66 2k4t s LYS 61 Ca -0.15 -0.75 0.00 0.00 0.02 0.00 0.00 55.97 55.09 2k4t s LYS 61 Cb -0.17 -2.57 -0.02 0.00 -0.52 0.00 0.00 37.83 34.55 2k4t s LYS 61 CO 0.06 0.11 -0.09 -0.47 -0.92 0.00 0.00 175.35 174.04 2k4t s TYR 62 N 0.58 2.88 0.12 3.18 5.04 0.88 -0.05 117.35 129.99 2k4t s TYR 62 Ca -0.10 -0.28 -0.12 0.00 -2.44 0.00 0.00 57.07 54.13 2k4t s TYR 62 Cb -0.16 -1.79 0.01 0.00 0.35 0.00 0.00 41.96 40.37 2k4t s TYR 62 CO 0.03 0.06 0.31 1.03 -1.34 0.00 0.00 175.55 175.64 2k4t s ARG 63 N -0.18 1.01 0.31 4.97 0.52 -1.26 -1.30 118.95 123.02 2k4t s ARG 63 Ca 0.01 -0.88 0.06 0.00 -0.52 0.00 0.00 55.73 54.40 2k4t s ARG 63 Cb -0.13 0.41 -0.02 0.00 0.52 0.00 0.00 34.95 35.73 2k4t s ARG 63 CO 0.03 -0.37 0.29 -2.67 0.02 0.00 0.00 175.30 172.60 2k4t n TRP 64 N -0.17 -0.83 -1.85 -0.53 2.14 -1.26 -4.61 117.44 110.33 2k4t n TRP 64 Ca -0.14 -2.52 -0.38 0.00 2.07 0.00 0.00 57.50 56.53 2k4t n TRP 64 Cb 0.63 0.30 -0.02 0.00 -0.81 0.00 0.00 31.31 31.42 2k4t n TRP 64 CO 0.00 0.00 0.00 0.25 2.07 0.00 0.00 177.69 180.01 2k4t n THR 65 N -0.58 4.91 -3.26 -1.67 -2.24 -1.26 -4.75 114.28 105.44 2k4t n THR 65 Ca 0.06 -3.95 -0.05 0.00 -2.27 0.00 0.00 64.05 57.84 2k4t n THR 65 Cb 0.55 -2.07 -0.04 0.00 -2.10 0.00 0.00 70.33 66.67 2k4t n THR 65 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2k4t s GLU 66 N -0.84 0.46 1.11 -0.78 2.56 -1.26 -5.13 118.70 114.81 2k4t s GLU 66 Ca 0.57 0.28 0.00 0.00 0.00 0.00 0.00 54.97 55.82 2k4t s GLU 66 Cb 0.21 -0.13 0.00 0.00 2.00 0.00 0.00 34.13 36.21 2k4t s GLU 66 CO -0.10 -1.02 0.00 0.66 -0.56 0.00 0.00 175.26 174.23 2k4t n TYR 67 N 5.37 -2.75 -2.54 5.30 4.01 -1.26 -4.12 117.16 121.17 2k4t n TYR 67 Ca 0.02 0.85 -0.41 0.00 -0.16 0.00 0.00 57.90 58.20 2k4t n TYR 67 Cb 0.51 -1.44 0.01 0.00 -0.31 0.00 0.00 39.34 38.11 2k4t n TYR 67 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2k4t n GLY 68 N -2.04 5.70 3.63 2.72 0.00 0.22 -4.92 105.19 110.50 2k4t n GLY 68 Ca 0.00 -2.45 -0.36 0.00 0.00 0.00 0.00 46.02 43.22 2k4t n GLY 68 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2k4t s LEU 69 N -3.34 3.93 -0.02 0.99 1.02 -1.26 -0.33 118.68 119.67 2k4t s LEU 69 Ca 0.41 0.07 0.04 0.00 0.02 0.00 0.00 54.13 54.67 2k4t s LEU 69 Cb 0.16 -2.03 -0.01 0.00 0.02 0.00 0.00 46.19 44.33 2k4t s LEU 69 CO -0.07 0.10 -0.13 -0.89 0.02 0.00 0.00 176.35 175.38 2k4t s THR 70 N 0.81 1.06 -0.25 5.49 2.01 -0.37 -4.42 115.64 119.96 2k4t s THR 70 Ca 0.06 -0.56 0.01 0.00 0.31 0.00 0.00 61.69 61.51 2k4t s THR 70 Cb -0.13 -0.89 0.07 0.00 0.01 0.00 0.00 72.50 71.56 2k4t s THR 70 CO 0.02 0.30 -0.02 -0.36 -0.69 0.00 0.00 174.62 173.88 2k4t s PHE 71 N -0.22 2.40 -0.37 4.92 0.08 -0.42 -1.27 117.98 123.09 2k4t s PHE 71 Ca 0.03 -1.86 -0.09 0.00 0.12 0.00 0.00 56.93 55.14 2k4t s PHE 71 Cb -0.06 -1.73 0.04 0.00 -0.57 0.00 0.00 43.02 40.70 2k4t s PHE 71 CO -0.00 -0.80 0.18 0.99 -0.10 0.00 0.00 175.22 175.49 2k4t s THR 72 N 1.39 4.23 -0.01 0.64 2.01 -0.35 -0.08 115.64 123.47 2k4t s THR 72 Ca -0.02 -1.06 0.02 0.00 0.31 0.00 0.00 61.69 60.95 2k4t s THR 72 Cb -0.19 -3.41 -0.00 0.00 0.01 0.00 0.00 72.50 68.90 2k4t s THR 72 CO -0.09 -0.27 -0.08 -1.83 -0.69 0.00 0.00 174.62 171.67 2k4t s GLU 73 N 1.48 0.66 0.00 4.92 4.04 -0.09 -0.03 118.70 129.68 2k4t s GLU 73 Ca 0.01 -0.28 0.00 0.00 0.04 0.00 0.00 54.97 54.74 2k4t s GLU 73 Cb -0.20 -0.64 0.00 0.00 0.02 0.00 0.00 34.13 33.31 2k4t s GLU 73 CO 0.04 0.16 0.00 1.17 -1.84 0.00 0.00 175.26 174.79 2k4t n LYS 74 N 2.94 0.00 -4.40 -4.83 3.00 -0.37 -2.53 118.16 111.98 2k4t n LYS 74 Ca -0.14 0.00 -0.29 0.00 -0.00 0.00 0.00 58.31 57.88 2k4t n LYS 74 Cb 0.57 0.00 -0.17 0.00 0.00 0.00 0.00 35.03 35.43 2k4t n LYS 74 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.40 176.94 2k4t s TRP 75 N -3.88 2.12 -0.03 5.64 -0.11 -0.83 -1.77 118.94 120.07 2k4t s TRP 75 Ca 0.00 -1.05 0.04 0.00 1.22 0.00 0.00 56.10 56.31 2k4t s TRP 75 Cb 0.00 -1.52 -0.03 0.00 -1.50 0.00 0.00 33.47 30.43 2k4t s TRP 75 CO 0.00 -0.54 -0.14 -0.80 -4.62 0.00 0.00 176.95 170.86 2k4t s ASN 76 N 1.06 4.09 -1.28 5.86 0.01 0.86 -1.64 114.94 123.90 2k4t s ASN 76 Ca -0.04 -0.21 0.00 0.00 -0.71 0.00 0.00 52.86 51.89 2k4t s ASN 76 Cb -0.15 -0.85 0.00 0.00 0.41 0.00 0.00 41.25 40.66 2k4t s ASN 76 CO -0.04 0.33 0.00 0.41 -1.51 0.00 0.00 177.10 176.29 2k4t n THR 77 N 2.11 -0.40 -4.12 1.60 -1.04 -1.26 -0.95 114.28 110.22 2k4t n THR 77 Ca -0.17 0.00 -0.34 0.00 -2.04 0.00 0.00 64.05 61.50 2k4t n THR 77 Cb 0.52 -1.69 -0.05 0.00 -1.82 0.00 0.00 70.33 67.29 2k4t n THR 77 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 2k4t n ASP 78 N -1.33 -2.12 0.00 8.00 5.75 -1.26 -4.50 116.55 121.09 2k4t n ASP 78 Ca -0.15 -0.90 0.00 0.00 -0.01 0.00 0.00 54.79 53.73 2k4t n ASP 78 Cb 0.55 -1.82 0.00 0.00 -1.03 0.00 0.00 41.12 38.82 2k4t n ASP 78 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 2k4t n ASN 79 N -2.34 0.00 -4.37 -1.12 3.02 -0.70 -5.06 115.26 104.69 2k4t n ASN 79 Ca 0.09 0.00 -0.44 0.00 -0.03 0.00 0.00 54.58 54.20 2k4t n ASN 79 Cb 0.47 0.06 -0.08 0.00 -0.61 0.00 0.00 39.78 39.62 2k4t n ASN 79 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2k4t s THR 80 N -1.20 5.04 -0.00 3.41 2.01 -0.13 -4.02 115.64 120.75 2k4t s THR 80 Ca 0.00 -1.12 0.07 0.00 0.31 0.00 0.00 61.69 60.95 2k4t s THR 80 Cb 0.00 -4.02 -0.03 0.00 0.01 0.00 0.00 72.50 68.46 2k4t s THR 80 CO 0.00 -0.56 -0.21 -1.48 -0.69 0.00 0.00 174.62 171.67 2k4t s LEU 81 N 1.60 2.37 0.00 4.42 2.34 -0.25 -0.10 118.68 129.06 2k4t s LEU 81 Ca 0.04 -0.41 0.00 0.00 0.06 0.00 0.00 54.13 53.82 2k4t s LEU 81 Cb -0.24 -1.43 0.00 0.00 -0.56 0.00 0.00 46.19 43.96 2k4t s LEU 81 CO 0.06 0.30 0.00 0.61 -1.06 0.00 0.00 176.35 176.26 2k4t n GLY 82 N 2.09 -0.62 3.16 -3.48 0.00 -0.73 -0.01 105.19 105.60 2k4t n GLY 82 Ca -0.16 -0.62 -0.09 0.00 0.00 0.00 0.00 46.02 45.15 2k4t n GLY 82 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2k4t s THR 83 N -3.58 0.15 -0.11 2.61 -1.32 -0.17 -1.23 115.64 111.99 2k4t s THR 83 Ca 0.00 -1.24 -0.03 0.00 -1.21 0.00 0.00 61.69 59.21 2k4t s THR 83 Cb 0.00 -1.23 0.04 0.00 -1.51 0.00 0.00 72.50 69.81 2k4t s THR 83 CO 0.00 -0.68 0.07 -0.70 -2.21 0.00 0.00 174.62 171.10 2k4t s GLU 84 N -3.45 0.06 -0.24 7.08 2.12 0.96 -0.27 118.70 124.97 2k4t s GLU 84 Ca 0.02 0.12 -0.08 0.00 0.36 0.00 0.00 54.97 55.39 2k4t s GLU 84 Cb 0.03 -1.20 -0.03 0.00 0.26 0.00 0.00 34.13 33.19 2k4t s GLU 84 CO -0.09 -0.49 0.09 0.96 -0.54 0.00 0.00 175.26 175.18 2k4t s ILE 85 N 2.13 4.54 -0.09 -3.70 -4.36 0.94 -1.21 121.20 119.45 2k4t s ILE 85 Ca 0.03 -0.10 0.03 0.00 -0.26 0.00 0.00 60.65 60.35 2k4t s ILE 85 Cb -0.14 -3.12 0.01 0.00 1.25 0.00 0.00 42.46 40.46 2k4t s ILE 85 CO -0.06 0.35 -0.17 0.42 0.24 0.00 0.00 174.94 175.72 2k4t s THR 86 N 1.40 1.53 -0.22 8.37 -4.23 -0.40 -0.43 115.64 121.66 2k4t s THR 86 Ca 0.06 -0.70 -0.04 0.00 -1.18 0.00 0.00 61.69 59.83 2k4t s THR 86 Cb -0.15 -1.37 -0.01 0.00 1.34 0.00 0.00 72.50 72.32 2k4t s THR 86 CO 0.04 0.44 -0.04 0.54 -0.54 0.00 0.00 174.62 175.07 2k4t s VAL 87 N 0.62 3.35 -0.09 2.29 0.11 0.11 -1.24 120.40 125.54 2k4t s VAL 87 Ca -0.14 -0.53 0.04 0.00 -2.93 0.00 0.00 61.98 58.42 2k4t s VAL 87 Cb -0.16 -2.53 0.00 0.00 -1.53 0.00 0.00 36.38 32.15 2k4t s VAL 87 CO 0.04 0.41 -0.22 -0.70 -3.33 0.00 0.00 175.10 171.30 2k4t s GLU 88 N 1.47 2.79 -0.30 1.54 -6.30 0.55 -1.52 118.70 116.93 2k4t s GLU 88 Ca 0.05 -0.80 -0.29 0.00 -2.50 0.00 0.00 54.97 51.43 2k4t s GLU 88 Cb -0.14 -2.14 0.01 0.00 0.00 0.00 0.00 34.13 31.86 2k4t s GLU 88 CO -0.03 0.17 1.20 0.16 0.02 0.00 0.00 175.26 176.78 2k4t s ASP 89 N 0.36 6.80 0.00 -1.70 -4.77 -1.26 -0.61 116.67 115.48 2k4t s ASP 89 Ca -0.17 1.16 0.00 0.00 -3.30 0.00 0.00 52.55 50.24 2k4t s ASP 89 Cb -0.17 -2.54 0.00 0.00 -1.09 0.00 0.00 42.92 39.12 2k4t s ASP 89 CO 0.08 -0.98 0.70 0.00 0.70 0.00 0.00 175.17 175.66 2k4t n GLN 90 N 7.10 0.00 -1.87 2.11 6.02 -1.26 -4.07 117.38 125.41 2k4t n GLN 90 Ca 0.13 0.26 -0.42 0.00 -0.01 0.00 0.00 57.00 56.96 2k4t n GLN 90 Cb 0.47 -1.22 -0.03 0.00 1.02 0.00 0.00 30.24 30.48 2k4t n GLN 90 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 2k4t s LEU 91 N -2.54 4.37 -0.87 1.08 1.98 -1.26 -3.21 118.68 118.23 2k4t s LEU 91 Ca 0.00 2.71 -0.04 0.00 -2.89 0.00 0.00 54.13 53.91 2k4t s LEU 91 Cb 0.00 -3.60 -0.05 0.00 0.66 0.00 0.00 46.19 43.20 2k4t s LEU 91 CO 0.00 -0.87 0.75 0.00 -1.89 0.00 0.00 176.35 174.34 2k4t n ALA 92 N 3.84 -2.08 -1.64 5.97 0.00 -1.26 -4.88 120.51 120.45 2k4t n ALA 92 Ca 0.14 0.10 -0.49 0.00 0.00 0.00 0.00 53.44 53.19 2k4t n ALA 92 Cb 0.37 -4.57 -0.05 0.00 0.00 0.00 0.00 19.45 15.20 2k4t n ALA 92 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2k4t n ARG 93 N -2.97 1.70 0.02 0.00 3.00 -1.20 -4.61 116.66 112.61 2k4t n ARG 93 Ca -0.07 0.62 0.00 0.00 -0.00 0.00 0.00 57.85 58.39 2k4t n ARG 93 Cb 0.60 -2.34 0.00 0.00 0.00 0.00 0.00 32.46 30.72 2k4t n ARG 93 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2k4t n GLY 94 N 3.24 -1.94 3.53 5.14 0.00 -1.26 -5.03 105.19 108.87 2k4t n GLY 94 Ca 0.19 0.61 -0.43 0.00 0.00 0.00 0.00 46.02 46.39 2k4t n GLY 94 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2k4t s LEU 95 N -4.27 4.28 -0.01 0.99 0.20 -1.26 -3.45 118.68 115.16 2k4t s LEU 95 Ca 0.00 -0.17 0.07 0.00 0.69 0.00 0.00 54.13 54.72 2k4t s LEU 95 Cb 0.00 -2.92 -0.02 0.00 -0.43 0.00 0.00 46.19 42.82 2k4t s LEU 95 CO 0.00 -0.94 -0.23 -0.54 -0.29 0.00 0.00 176.35 174.34 2k4t s LYS 96 N 3.31 1.87 -0.03 1.98 1.02 -0.50 -3.99 119.74 123.39 2k4t s LYS 96 Ca 0.29 -0.86 0.04 0.00 0.02 0.00 0.00 55.97 55.46 2k4t s LYS 96 Cb -0.12 -1.83 -0.00 0.00 -0.52 0.00 0.00 37.83 35.35 2k4t s LYS 96 CO 0.22 0.50 -0.14 -1.17 -0.92 0.00 0.00 175.35 173.83 2k4t s LEU 97 N -0.63 1.90 -0.14 3.17 1.98 -0.57 -1.00 118.68 123.39 2k4t s LEU 97 Ca 0.09 -0.29 -0.03 0.00 -2.89 0.00 0.00 54.13 51.01 2k4t s LEU 97 Cb -0.09 -0.81 0.05 0.00 0.66 0.00 0.00 46.19 46.00 2k4t s LEU 97 CO -0.01 0.14 0.04 0.42 -1.89 0.00 0.00 176.35 175.06 2k4t s THR 98 N -0.01 0.24 -0.28 3.68 -4.23 -0.25 0.06 115.64 114.85 2k4t s THR 98 Ca -0.01 -0.15 -0.04 0.00 -1.18 0.00 0.00 61.69 60.30 2k4t s THR 98 Cb -0.09 -0.67 0.02 0.00 1.34 0.00 0.00 72.50 73.10 2k4t s THR 98 CO 0.01 -0.06 0.02 0.12 -0.54 0.00 0.00 174.62 174.17 2k4t s PHE 99 N 2.00 3.15 -0.18 3.99 2.19 0.42 -0.34 117.98 129.22 2k4t s PHE 99 Ca 0.02 -1.35 -0.03 0.00 0.33 0.00 0.00 56.93 55.90 2k4t s PHE 99 Cb -0.15 -2.17 -0.02 0.00 -1.31 0.00 0.00 43.02 39.37 2k4t s PHE 99 CO -0.07 -0.68 -0.05 0.16 1.83 0.00 0.00 175.22 176.41 2k4t s ASP 100 N 1.39 4.52 -0.19 6.13 -4.77 -0.36 -0.04 116.67 123.35 2k4t s ASP 100 Ca 0.00 -0.25 0.01 0.00 -3.30 0.00 0.00 52.55 49.01 2k4t s ASP 100 Cb -0.18 -1.75 0.03 0.00 -1.09 0.00 0.00 42.92 39.94 2k4t s ASP 100 CO -0.00 0.10 -0.16 -0.44 0.70 0.00 0.00 175.17 175.37 2k4t s SER 101 N 0.78 3.36 0.17 2.11 0.01 0.63 -1.32 113.70 119.44 2k4t s SER 101 Ca -0.02 -0.81 0.09 0.00 1.31 0.00 0.00 55.95 56.52 2k4t s SER 101 Cb -0.15 -1.41 -0.04 0.00 0.21 0.00 0.00 66.02 64.64 2k4t s SER 101 CO 0.02 -0.07 -0.10 -0.44 0.41 0.00 0.00 173.24 173.06 2k4t s SER 102 N 1.30 4.26 -0.08 2.44 0.01 -0.34 -1.00 113.70 120.29 2k4t s SER 102 Ca 0.01 -0.55 -0.04 0.00 1.31 0.00 0.00 55.95 56.68 2k4t s SER 102 Cb -0.15 -0.73 0.04 0.00 0.21 0.00 0.00 66.02 65.39 2k4t s SER 102 CO -0.10 0.11 0.20 0.12 0.41 0.00 0.00 173.24 173.98 2k4t s PHE 103 N -1.62 -0.24 0.03 2.43 5.36 0.98 -1.43 117.98 123.49 2k4t s PHE 103 Ca 0.24 0.62 0.05 0.00 -0.96 0.00 0.00 56.93 56.89 2k4t s PHE 103 Cb -0.09 -0.00 -0.03 0.00 -0.34 0.00 0.00 43.02 42.55 2k4t s PHE 103 CO 0.15 -0.19 -0.13 -1.12 -1.46 0.00 0.00 175.22 172.47 2k4t s SER 104 N 1.06 4.15 0.33 6.13 0.01 0.15 -1.09 113.70 124.43 2k4t s SER 104 Ca -0.08 -0.31 0.00 0.00 1.31 0.00 0.00 55.95 56.87 2k4t s SER 104 Cb -0.10 -0.81 0.00 0.00 0.21 0.00 0.00 66.02 65.33 2k4t s SER 104 CO -0.06 0.26 0.00 -0.81 0.41 0.00 0.00 173.24 173.04 2k4t n PRO 105 N 1.54 0.34 -0.42 12.44 -0.04 -1.26 -3.82 135.00 143.78 2k4t n PRO 105 Ca -0.16 0.00 0.36 0.00 -0.04 0.00 0.00 63.50 63.66 2k4t n PRO 105 Cb 0.52 0.00 0.63 0.00 -0.04 0.00 0.00 33.50 34.62 2k4t n PRO 105 CO 0.00 0.00 0.00 -0.97 -0.04 0.00 0.00 175.50 174.49 2k4t h ASN 106 N -0.33 0.27 -0.53 3.54 -1.24 -2.00 0.74 115.58 116.03 2k4t h ASN 106 Ca 0.00 0.16 -0.38 0.00 0.71 0.00 0.00 56.30 56.79 2k4t h ASN 106 Cb 0.00 0.15 -0.11 0.00 0.73 0.00 0.00 38.32 39.09 2k4t h ASN 106 CO 0.00 -0.22 0.32 0.41 -1.29 0.00 0.00 177.43 176.65 2k4t n THR 107 N -4.80 3.33 -3.35 -3.57 -1.04 -1.26 -4.86 114.28 98.73 2k4t n THR 107 Ca 0.37 -2.36 0.00 0.00 -2.04 0.00 0.00 64.05 60.02 2k4t n THR 107 Cb 1.40 -1.86 0.00 0.00 -1.82 0.00 0.00 70.33 68.05 2k4t n THR 107 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2k4t n GLY 108 N 1.80 -0.35 1.67 3.41 0.00 0.25 -5.00 105.19 106.97 2k4t n GLY 108 Ca 0.48 -1.17 -0.07 0.00 0.00 0.00 0.00 46.02 45.26 2k4t n GLY 108 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2k4t n LYS 109 N 0.00 0.35 -4.01 1.61 5.02 -1.25 -4.70 118.16 115.18 2k4t n LYS 109 Ca 0.00 -1.39 -0.34 0.00 -2.02 0.00 0.00 58.31 54.56 2k4t n LYS 109 Cb 0.00 1.33 -0.06 0.00 -0.02 0.00 0.00 35.03 36.28 2k4t n LYS 109 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 2k4t s LYS 110 N -2.40 3.25 -0.24 1.97 -2.85 -1.26 -0.68 119.74 117.54 2k4t s LYS 110 Ca 0.14 -0.36 -0.15 0.00 -1.00 0.00 0.00 55.97 54.60 2k4t s LYS 110 Cb -0.00 -2.99 0.07 0.00 -2.06 0.00 0.00 37.83 32.84 2k4t s LYS 110 CO 0.10 0.68 0.59 -0.80 0.10 0.00 0.00 175.35 176.03 2k4t s ASN 111 N -1.63 -0.76 -0.01 0.03 0.01 -0.51 -4.84 114.94 107.22 2k4t s ASN 111 Ca 0.22 1.28 0.03 0.00 -0.71 0.00 0.00 52.86 53.68 2k4t s ASN 111 Cb -0.12 1.18 -0.01 0.00 0.41 0.00 0.00 41.25 42.71 2k4t s ASN 111 CO 0.13 -0.22 -0.10 0.00 -1.51 0.00 0.00 177.10 175.40 2k4t s ALA 112 N 1.31 0.85 0.03 0.60 0.00 -1.24 -1.20 121.76 122.11 2k4t s ALA 112 Ca -0.08 -0.42 0.01 0.00 0.00 0.00 0.00 51.96 51.47 2k4t s ALA 112 Cb -0.06 -0.23 -0.02 0.00 0.00 0.00 0.00 23.12 22.81 2k4t s ALA 112 CO -0.14 0.20 -0.05 -1.59 0.00 0.00 0.00 175.76 174.18 2k4t s LYS 113 N -0.16 0.41 -0.03 0.00 -2.85 -0.44 -1.38 119.74 115.29 2k4t s LYS 113 Ca 0.03 -0.65 0.05 0.00 -1.00 0.00 0.00 55.97 54.40 2k4t s LYS 113 Cb -0.05 -0.11 -0.01 0.00 -2.06 0.00 0.00 37.83 35.60 2k4t s LYS 113 CO -0.00 0.01 -0.18 -1.50 0.10 0.00 0.00 175.35 173.77 2k4t s ILE 114 N -1.32 1.46 -0.18 3.79 2.07 0.70 -1.23 121.20 126.49 2k4t s ILE 114 Ca -0.12 -0.76 0.01 0.00 -1.41 0.00 0.00 60.65 58.36 2k4t s ILE 114 Cb -0.09 -1.23 0.02 0.00 0.13 0.00 0.00 42.46 41.28 2k4t s ILE 114 CO -0.00 0.42 -0.19 -0.54 -1.91 0.00 0.00 174.94 172.72 2k4t s LYS 115 N -0.21 3.00 -0.30 3.50 -0.14 0.54 -0.64 119.74 125.48 2k4t s LYS 115 Ca 0.02 -0.82 -0.03 0.00 -1.36 0.00 0.00 55.97 53.78 2k4t s LYS 115 Cb -0.09 -2.61 0.05 0.00 -1.68 0.00 0.00 37.83 33.49 2k4t s LYS 115 CO 0.01 -0.22 0.01 0.99 -0.76 0.00 0.00 175.35 175.38 2k4t s THR 116 N 1.30 3.12 -0.24 2.17 2.01 0.94 -1.09 115.64 123.86 2k4t s THR 116 Ca 0.05 -1.31 -0.08 0.00 0.31 0.00 0.00 61.69 60.66 2k4t s THR 116 Cb -0.13 -2.77 -0.04 0.00 0.01 0.00 0.00 72.50 69.57 2k4t s THR 116 CO -0.12 -0.09 0.10 -0.83 -0.69 0.00 0.00 174.62 172.99 2k4t s GLY 117 N 1.29 1.85 -0.20 4.40 0.00 -0.17 -0.72 107.32 113.77 2k4t s GLY 117 Ca -0.04 -1.01 0.00 0.00 0.00 0.00 0.00 44.72 43.67 2k4t s GLY 117 CO -0.01 0.43 -0.06 -0.47 0.00 0.00 0.00 173.10 172.99 2k4t s TYR 118 N 1.29 2.10 -0.20 1.90 5.04 0.73 -1.41 117.35 126.80 2k4t s TYR 118 Ca 0.06 -1.44 -0.09 0.00 -2.44 0.00 0.00 57.07 53.16 2k4t s TYR 118 Cb -0.15 -1.48 -0.05 0.00 0.35 0.00 0.00 41.96 40.64 2k4t s TYR 118 CO 0.05 -0.70 0.11 -1.59 -1.34 0.00 0.00 175.55 172.07 2k4t s LYS 119 N 1.50 4.08 0.48 4.97 -2.85 -1.22 -0.10 119.74 126.59 2k4t s LYS 119 Ca -0.02 -0.28 0.05 0.00 -1.00 0.00 0.00 55.97 54.73 2k4t s LYS 119 Cb -0.17 -3.35 -0.01 0.00 -2.06 0.00 0.00 37.83 32.24 2k4t s LYS 119 CO -0.07 0.25 0.23 0.50 0.10 0.00 0.00 175.35 176.36 2k4t s ARG 120 N 0.47 2.24 0.41 1.78 3.52 -0.81 -4.82 118.95 121.74 2k4t s ARG 120 Ca 0.06 -2.00 0.21 0.00 -0.13 0.00 0.00 55.73 53.87 2k4t s ARG 120 Cb -0.12 -1.95 0.86 0.00 -1.56 0.00 0.00 34.95 32.17 2k4t s ARG 120 CO -0.00 -0.34 1.81 0.93 -0.81 0.00 0.00 175.30 176.89 2k4t h GLU 121 N 1.16 0.00 0.00 5.12 3.07 -2.03 -3.35 114.58 118.54 2k4t h GLU 121 Ca -0.41 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.45 2k4t h GLU 121 Cb 1.28 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.19 2k4t h GLU 121 CO 0.66 0.30 -0.27 0.72 -1.40 0.00 0.00 179.01 179.02 2k4t n HIS 122 N -3.55 0.34 -4.17 4.33 8.25 -1.26 -5.05 115.22 114.12 2k4t n HIS 122 Ca -0.00 0.15 -0.10 0.00 -0.26 0.00 0.00 57.72 57.50 2k4t n HIS 122 Cb 0.44 -0.44 -0.10 0.00 1.12 0.00 0.00 29.99 31.02 2k4t n HIS 122 CO 0.00 0.00 0.00 0.96 0.64 0.00 0.00 176.34 177.94 2k4t s ILE 123 N -1.61 0.50 -0.21 1.59 -4.36 -1.26 -4.63 121.20 111.22 2k4t s ILE 123 Ca -0.08 -1.92 -0.08 0.00 -0.26 0.00 0.00 60.65 58.32 2k4t s ILE 123 Cb 0.01 -1.81 -0.04 0.00 1.25 0.00 0.00 42.46 41.87 2k4t s ILE 123 CO 0.11 -0.74 0.08 0.20 0.24 0.00 0.00 174.94 174.83 2k4t s ASN 124 N -3.05 5.55 -0.09 4.36 0.02 -0.07 -1.92 114.94 119.74 2k4t s ASN 124 Ca 0.16 -0.01 0.01 0.00 -1.02 0.00 0.00 52.86 52.00 2k4t s ASN 124 Cb 0.06 -1.97 -0.02 0.00 0.02 0.00 0.00 41.25 39.34 2k4t s ASN 124 CO -0.03 0.09 -0.10 -0.22 0.02 0.00 0.00 177.10 176.86 2k4t s LEU 125 N 0.89 2.92 -0.20 0.60 1.98 0.86 -1.25 118.68 124.47 2k4t s LEU 125 Ca 0.04 -0.17 -0.02 0.00 -2.89 0.00 0.00 54.13 51.09 2k4t s LEU 125 Cb -0.14 -1.64 0.06 0.00 0.66 0.00 0.00 46.19 45.13 2k4t s LEU 125 CO 0.03 0.28 0.01 -0.83 -1.89 0.00 0.00 176.35 173.94 2k4t s GLY 126 N -0.30 0.86 -0.05 7.98 0.00 0.86 -0.19 107.32 116.47 2k4t s GLY 126 Ca 0.03 -0.86 -0.06 0.00 0.00 0.00 0.00 44.72 43.83 2k4t s GLY 126 CO 0.03 1.29 0.19 0.00 0.00 0.00 0.00 173.10 174.61 2k4t s ASP 128 N -1.44 0.77 -0.05 0.00 2.15 0.25 -0.04 116.67 118.30 2k4t s ASP 128 Ca 0.22 -0.10 0.06 0.00 0.43 0.00 0.00 52.55 53.15 2k4t s ASP 128 Cb -0.13 -0.32 -0.01 0.00 -0.30 0.00 0.00 42.92 42.17 2k4t s ASP 128 CO 0.11 -0.03 -0.24 -0.32 -0.17 0.00 0.00 175.17 174.52 2k4t s MET 129 N 0.66 2.51 -0.08 4.34 1.75 0.18 0.04 119.30 128.71 2k4t s MET 129 Ca -0.08 -0.90 0.02 0.00 -1.25 0.00 0.00 55.69 53.48 2k4t s MET 129 Cb -0.11 -2.17 0.01 0.00 2.84 0.00 0.00 34.83 35.40 2k4t s MET 129 CO -0.00 0.41 -0.13 -0.51 -0.65 0.00 0.00 175.02 174.14 2k4t s ASP 130 N -0.23 2.06 -0.38 1.11 1.01 -0.38 -0.21 116.67 119.64 2k4t s ASP 130 Ca -0.01 -0.35 -0.10 0.00 0.71 0.00 0.00 52.55 52.80 2k4t s ASP 130 Cb -0.13 -0.92 0.04 0.00 1.01 0.00 0.00 42.92 42.91 2k4t s ASP 130 CO 0.03 0.01 0.21 0.12 0.21 0.00 0.00 175.17 175.75 2k4t s PHE 131 N 0.87 3.25 0.51 4.23 5.36 -0.48 -1.06 117.98 130.66 2k4t s PHE 131 Ca -0.10 -1.07 0.02 0.00 -0.96 0.00 0.00 56.93 54.82 2k4t s PHE 131 Cb -0.15 -2.48 -0.01 0.00 -0.34 0.00 0.00 43.02 40.03 2k4t s PHE 131 CO 0.01 -0.68 0.03 0.34 -1.46 0.00 0.00 175.22 173.45 2k4t s ASP 132 N 1.60 4.15 -0.07 6.13 2.15 -1.23 -3.64 116.67 125.76 2k4t s ASP 132 Ca 0.02 -1.61 -0.17 0.00 0.43 0.00 0.00 52.55 51.22 2k4t s ASP 132 Cb -0.20 0.46 -0.13 0.00 -0.30 0.00 0.00 42.92 42.75 2k4t s ASP 132 CO 0.06 -0.84 0.64 0.40 -0.17 0.00 0.00 175.17 175.26 2k4t h ILE 133 N 1.34 0.66 -0.86 4.11 5.03 -1.98 -3.27 117.51 122.54 2k4t h ILE 133 Ca -0.44 -1.18 0.22 0.00 -0.12 0.00 0.00 64.86 63.35 2k4t h ILE 133 Cb 1.31 1.15 -0.05 0.00 -3.03 0.00 0.00 36.82 36.21 2k4t h ILE 133 CO 0.74 0.19 0.60 0.00 -0.68 0.00 0.00 178.15 178.99 2k4t h ALA 134 N -0.54 2.53 0.00 1.87 0.00 -2.02 -3.46 119.26 117.64 2k4t h ALA 134 Ca -0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2k4t h ALA 134 Cb 0.46 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2k4t h ALA 134 CO 0.03 -0.79 0.00 0.41 0.00 0.00 0.00 179.25 178.90 2k4t n GLY 135 N -1.62 2.81 3.77 0.00 0.00 -1.23 -4.96 105.19 103.96 2k4t n GLY 135 Ca 0.18 -1.03 -0.33 0.00 0.00 0.00 0.00 46.02 44.84 2k4t n GLY 135 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2k4t s PRO 136 N -2.05 2.86 -0.05 1.61 0.04 -1.26 -3.56 135.00 132.59 2k4t s PRO 136 Ca 0.00 1.41 0.01 0.00 0.04 0.00 0.00 61.00 62.45 2k4t s PRO 136 Cb 0.00 -1.96 0.02 0.00 0.04 0.00 0.00 34.50 32.61 2k4t s PRO 136 CO 0.00 -1.21 -0.03 -1.12 0.04 0.00 0.00 177.00 174.68 2k4t s SER 137 N -2.51 0.94 -0.39 6.66 0.01 -0.23 -4.57 113.70 113.62 2k4t s SER 137 Ca 0.67 -0.11 -0.11 0.00 1.31 0.00 0.00 55.95 57.72 2k4t s SER 137 Cb -0.21 -0.41 0.04 0.00 0.21 0.00 0.00 66.02 65.65 2k4t s SER 137 CO 0.40 -0.08 0.22 -0.63 0.41 0.00 0.00 173.24 173.56 2k4t s ILE 138 N 1.07 4.53 -0.20 1.44 1.09 -0.48 -1.25 121.20 127.40 2k4t s ILE 138 Ca -0.09 -0.98 -0.14 0.00 -1.10 0.00 0.00 60.65 58.35 2k4t s ILE 138 Cb -0.14 -3.59 -0.04 0.00 -1.06 0.00 0.00 42.46 37.63 2k4t s ILE 138 CO -0.01 -0.30 0.29 -0.13 -0.10 0.00 0.00 174.94 174.69 2k4t s ARG 139 N 1.53 4.16 -0.15 2.79 0.52 0.11 0.17 118.95 128.08 2k4t s ARG 139 Ca 0.02 0.02 -0.02 0.00 -0.52 0.00 0.00 55.73 55.23 2k4t s ARG 139 Cb -0.20 -3.51 -0.02 0.00 0.52 0.00 0.00 34.95 31.74 2k4t s ARG 139 CO 0.06 0.06 -0.08 0.20 0.02 0.00 0.00 175.30 175.56 2k4t s GLY 140 N 0.90 1.63 -0.16 -3.53 0.00 0.04 -0.58 107.32 105.61 2k4t s GLY 140 Ca 0.15 -0.88 -0.01 0.00 0.00 0.00 0.00 44.72 43.98 2k4t s GLY 140 CO 0.06 -0.08 -0.03 0.00 0.00 0.00 0.00 173.10 173.04 2k4t s ALA 141 N 0.44 1.34 -0.22 3.20 0.00 0.17 -1.33 121.76 125.36 2k4t s ALA 141 Ca -0.06 -0.76 -0.05 0.00 0.00 0.00 0.00 51.96 51.09 2k4t s ALA 141 Cb -0.15 -1.10 -0.01 0.00 0.00 0.00 0.00 23.12 21.85 2k4t s ALA 141 CO 0.04 -0.83 -0.02 -1.17 0.00 0.00 0.00 175.76 173.78 2k4t s LEU 142 N 1.70 3.01 -0.06 0.00 2.96 -0.39 -0.10 118.68 125.78 2k4t s LEU 142 Ca 0.01 -0.35 0.05 0.00 -0.22 0.00 0.00 54.13 53.61 2k4t s LEU 142 Cb -0.15 -1.78 -0.00 0.00 0.50 0.00 0.00 46.19 44.76 2k4t s LEU 142 CO -0.07 -0.02 -0.21 0.68 -1.32 0.00 0.00 176.35 175.41 2k4t s VAL 143 N 1.48 1.77 0.05 1.68 -7.23 -0.38 -0.00 120.40 117.76 2k4t s VAL 143 Ca 0.06 -0.88 0.04 0.00 -1.81 0.00 0.00 61.98 59.38 2k4t s VAL 143 Cb -0.14 -1.52 -0.04 0.00 0.56 0.00 0.00 36.38 35.24 2k4t s VAL 143 CO -0.02 0.50 -0.03 -0.76 -0.31 0.00 0.00 175.10 174.48 2k4t s LEU 144 N 0.12 3.37 -0.14 1.32 2.01 0.87 -0.89 118.68 125.34 2k4t s LEU 144 Ca -0.09 -0.16 0.02 0.00 0.01 0.00 0.00 54.13 53.92 2k4t s LEU 144 Cb -0.14 -2.04 0.01 0.00 0.01 0.00 0.00 46.19 44.03 2k4t s LEU 144 CO 0.05 0.22 -0.21 -0.83 1.01 0.00 0.00 176.35 176.59 2k4t s GLY 145 N -1.94 1.38 0.24 -3.19 0.00 -1.26 -1.54 107.32 101.01 2k4t s GLY 145 Ca 0.22 -1.08 0.10 0.00 0.00 0.00 0.00 44.72 43.96 2k4t s GLY 145 CO 0.14 -0.04 -0.18 -0.19 0.00 0.00 0.00 173.10 172.83 2k4t s TYR 146 N 0.78 2.02 0.26 1.90 1.51 0.89 -5.00 117.35 119.71 2k4t s TYR 146 Ca -0.08 -0.44 -0.10 0.00 -1.01 0.00 0.00 57.07 55.45 2k4t s TYR 146 Cb -0.16 -0.90 0.39 0.00 -0.11 0.00 0.00 41.96 41.18 2k4t s TYR 146 CO -0.01 0.55 1.58 1.05 -1.11 0.00 0.00 175.55 177.61 2k4t h GLU 147 N 2.44 0.00 0.00 -0.62 4.11 -2.02 -3.08 114.58 115.41 2k4t h GLU 147 Ca -0.39 -0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.04 2k4t h GLU 147 Cb 1.24 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.49 2k4t h GLU 147 CO 0.60 0.00 0.00 0.41 0.07 0.00 0.00 179.01 180.10 2k4t n GLY 148 N -1.56 -0.28 3.46 1.06 0.00 -1.26 -5.02 105.19 101.59 2k4t n GLY 148 Ca 0.13 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.89 2k4t n GLY 148 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2k4t s TRP 149 N -0.24 2.34 -0.08 1.61 0.52 -1.17 -1.82 118.94 120.10 2k4t s TRP 149 Ca 0.00 -0.33 -0.06 0.00 0.02 0.00 0.00 56.10 55.73 2k4t s TRP 149 Cb 0.00 -1.11 0.03 0.00 -1.15 0.00 0.00 33.47 31.24 2k4t s TRP 149 CO 0.00 0.58 0.19 -0.51 0.02 0.00 0.00 176.95 177.23 2k4t s LEU 150 N -2.99 1.00 0.07 2.99 1.43 0.12 -0.08 118.68 121.22 2k4t s LEU 150 Ca 0.24 0.40 0.06 0.00 -1.03 0.00 0.00 54.13 53.80 2k4t s LEU 150 Cb -0.07 0.62 -0.03 0.00 0.03 0.00 0.00 46.19 46.74 2k4t s LEU 150 CO 0.12 -0.10 -0.17 0.00 0.23 0.00 0.00 176.35 176.43 2k4t s ALA 151 N 0.52 1.43 -0.29 4.21 0.00 -0.59 -0.57 121.76 126.48 2k4t s ALA 151 Ca -0.03 -1.02 0.04 0.00 0.00 0.00 0.00 51.96 50.94 2k4t s ALA 151 Cb -0.05 -0.20 0.19 0.00 0.00 0.00 0.00 23.12 23.06 2k4t s ALA 151 CO -0.03 0.27 0.54 0.20 0.00 0.00 0.00 175.76 176.74 2k4t s GLY 152 N -1.52 -1.04 -0.22 0.00 0.00 0.12 -0.09 107.32 104.58 2k4t s GLY 152 Ca 0.03 0.88 -0.11 0.00 0.00 0.00 0.00 44.72 45.52 2k4t s GLY 152 CO 0.02 3.46 0.20 -0.47 0.00 0.00 0.00 173.10 176.32 2k4t s TYR 153 N 2.75 3.35 -0.17 1.90 5.04 0.99 0.02 117.35 131.24 2k4t s TYR 153 Ca 0.11 0.33 -0.01 0.00 -2.44 0.00 0.00 57.07 55.06 2k4t s TYR 153 Cb -0.11 -2.29 -0.01 0.00 0.35 0.00 0.00 41.96 39.90 2k4t s TYR 153 CO -0.27 0.11 -0.11 -1.14 -1.34 0.00 0.00 175.55 172.81 2k4t s GLN 154 N 0.91 3.32 0.08 4.97 0.74 -0.21 -1.27 119.66 128.20 2k4t s GLN 154 Ca 0.10 -0.69 -0.05 0.00 0.05 0.00 0.00 55.36 54.77 2k4t s GLN 154 Cb -0.13 -2.76 -0.02 0.00 1.10 0.00 0.00 33.01 31.20 2k4t s GLN 154 CO 0.04 -0.01 0.10 0.00 -0.55 0.00 0.00 175.29 174.87 2k4t s MET 155 N 0.92 0.77 0.27 1.67 0.23 -0.44 -1.01 119.30 121.72 2k4t s MET 155 Ca -0.02 -1.09 0.11 0.00 -1.03 0.00 0.00 55.69 53.66 2k4t s MET 155 Cb -0.15 0.29 -0.05 0.00 -1.53 0.00 0.00 34.83 33.39 2k4t s MET 155 CO -0.01 -0.21 -0.11 -0.80 -2.03 0.00 0.00 175.02 171.86 2k4t s ASN 156 N -2.90 4.01 -0.23 -1.18 -0.87 -1.24 -0.78 114.94 111.75 2k4t s ASN 156 Ca 0.07 -0.85 -0.04 0.00 -1.57 0.00 0.00 52.86 50.47 2k4t s ASN 156 Cb 0.06 -0.54 0.09 0.00 -0.02 0.00 0.00 41.25 40.84 2k4t s ASN 156 CO -0.10 0.03 0.15 -0.36 -2.57 0.00 0.00 177.10 174.25 2k4t s PHE 157 N -2.40 0.05 -0.27 2.20 0.08 0.13 -4.71 117.98 113.05 2k4t s PHE 157 Ca 0.30 -0.34 -0.06 0.00 0.12 0.00 0.00 56.93 56.95 2k4t s PHE 157 Cb -0.06 -0.65 0.00 0.00 -0.57 0.00 0.00 43.02 41.75 2k4t s PHE 157 CO 0.17 -0.67 0.05 -2.00 -0.10 0.00 0.00 175.22 172.66 2k4t s GLU 158 N 2.20 3.16 -0.02 0.44 2.12 -1.26 -1.38 118.70 123.95 2k4t s GLU 158 Ca 0.06 -0.80 -0.03 0.00 0.36 0.00 0.00 54.97 54.57 2k4t s GLU 158 Cb -0.16 -3.27 -0.27 0.00 0.26 0.00 0.00 34.13 30.69 2k4t s GLU 158 CO -0.21 -0.38 0.75 0.00 -0.54 0.00 0.00 175.26 174.88 2k4t h THR 159 N 5.84 1.02 0.03 -1.70 1.03 -1.93 -2.74 112.91 114.46 2k4t h THR 159 Ca -0.34 -2.69 -0.00 0.00 -0.01 0.00 0.00 66.41 63.37 2k4t h THR 159 Cb 1.13 2.68 0.00 0.00 -1.07 0.00 0.00 68.15 70.90 2k4t h THR 159 CO 0.60 0.80 -0.01 0.00 -0.01 0.00 0.00 175.52 176.89 2k4t h ALA 160 N 0.45 -0.04 0.00 0.00 0.00 -1.93 -3.09 119.26 114.65 2k4t h ALA 160 Ca -0.28 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2k4t h ALA 160 Cb 2.03 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.83 2k4t h ALA 160 CO 0.14 -0.29 0.00 0.87 0.00 0.00 0.00 179.25 179.97 2k4t h LYS 161 N -0.50 0.00 -0.62 0.00 1.79 -1.91 -3.46 116.57 111.86 2k4t h LYS 161 Ca -0.00 0.00 -0.27 0.00 -2.18 0.00 0.00 60.65 58.20 2k4t h LYS 161 Cb 0.47 0.00 -0.11 0.00 -1.58 0.00 0.00 32.23 31.01 2k4t h LYS 161 CO 0.01 0.00 -0.24 0.43 -1.08 0.00 0.00 179.45 178.56 2k4t n SER 162 N -2.77 -5.10 -3.57 0.86 7.64 -1.04 -4.93 113.62 104.71 2k4t n SER 162 Ca 0.02 0.32 -0.02 0.00 1.01 0.00 0.00 58.87 60.21 2k4t n SER 162 Cb 0.35 -3.75 -0.05 0.00 -1.01 0.00 0.00 64.21 59.74 2k4t n SER 162 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2k4t s ARG 163 N -3.02 0.52 0.51 1.43 0.52 -1.19 -5.02 118.95 112.70 2k4t s ARG 163 Ca 0.00 1.28 -0.21 0.00 -0.52 0.00 0.00 55.73 56.29 2k4t s ARG 163 Cb 0.00 0.69 -0.06 0.00 0.52 0.00 0.00 34.95 36.09 2k4t s ARG 163 CO 0.00 -0.29 1.15 0.14 0.02 0.00 0.00 175.30 176.32 2k4t s VAL 164 N 2.83 3.13 0.00 3.52 -7.23 -1.26 -4.56 120.40 116.83 2k4t s VAL 164 Ca -0.01 0.76 0.00 0.00 -1.81 0.00 0.00 61.98 60.93 2k4t s VAL 164 Cb -0.13 -3.34 0.00 0.00 0.56 0.00 0.00 36.38 33.47 2k4t s VAL 164 CO -0.18 -0.10 0.57 0.35 -0.31 0.00 0.00 175.10 175.43 2k4t n THR 165 N -0.98 0.00 -3.98 5.32 -2.24 -1.26 -4.96 114.28 106.18 2k4t n THR 165 Ca 0.10 1.07 -0.09 0.00 -2.27 0.00 0.00 64.05 62.86 2k4t n THR 165 Cb 0.50 -1.92 -0.05 0.00 -2.10 0.00 0.00 70.33 66.76 2k4t n THR 165 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2k4t s GLN 166 N -1.26 1.56 -0.10 -0.78 -2.07 -1.26 -5.08 119.66 110.66 2k4t s GLN 166 Ca 0.00 -1.22 0.01 0.00 -1.82 0.00 0.00 55.36 52.33 2k4t s GLN 166 Cb 0.00 0.48 0.02 0.00 -1.09 0.00 0.00 33.01 32.42 2k4t s GLN 166 CO 0.00 -0.65 -0.10 0.45 -1.32 0.00 0.00 175.29 173.67 2k4t s SER 167 N -3.00 2.07 0.16 12.60 0.15 -1.26 -3.64 113.70 120.77 2k4t s SER 167 Ca 0.21 -0.32 0.09 0.00 0.70 0.00 0.00 55.95 56.63 2k4t s SER 167 Cb -0.01 -0.87 -0.04 0.00 -1.71 0.00 0.00 66.02 63.39 2k4t s SER 167 CO 0.08 -0.05 -0.19 0.54 1.20 0.00 0.00 173.24 174.82 2k4t s ASN 168 N 1.28 2.71 -0.02 5.45 4.22 -0.18 -0.07 114.94 128.34 2k4t s ASN 168 Ca -0.03 -0.85 0.04 0.00 -2.14 0.00 0.00 52.86 49.89 2k4t s ASN 168 Cb -0.14 -0.16 -0.01 0.00 1.28 0.00 0.00 41.25 42.22 2k4t s ASN 168 CO -0.04 -0.02 -0.15 0.12 -2.04 0.00 0.00 177.10 174.97 2k4t s PHE 169 N -1.94 1.44 0.04 1.54 5.36 -0.38 -1.04 117.98 122.99 2k4t s PHE 169 Ca 0.15 -0.32 0.07 0.00 -0.96 0.00 0.00 56.93 55.87 2k4t s PHE 169 Cb -0.06 -0.95 -0.02 0.00 -0.34 0.00 0.00 43.02 41.65 2k4t s PHE 169 CO 0.07 -0.07 -0.20 0.00 -1.46 0.00 0.00 175.22 173.56 2k4t s ALA 170 N -0.21 1.65 0.01 11.12 0.00 0.10 -0.83 121.76 133.60 2k4t s ALA 170 Ca 0.03 -0.99 -0.01 0.00 0.00 0.00 0.00 51.96 50.99 2k4t s ALA 170 Cb -0.08 -0.33 -0.01 0.00 0.00 0.00 0.00 23.12 22.71 2k4t s ALA 170 CO 0.00 0.37 -0.00 0.08 0.00 0.00 0.00 175.76 176.21 2k4t s VAL 171 N -0.76 0.05 -0.01 0.00 1.01 0.91 -0.70 120.40 120.90 2k4t s VAL 171 Ca 0.07 -0.42 0.01 0.00 0.00 0.00 0.00 61.98 61.63 2k4t s VAL 171 Cb -0.08 -0.14 0.00 0.00 0.00 0.00 0.00 36.38 36.16 2k4t s VAL 171 CO 0.01 -0.23 -0.02 -0.83 0.00 0.00 0.00 175.10 174.03 2k4t s GLY 172 N -0.68 0.14 -0.10 4.51 0.00 0.27 -0.46 107.32 111.00 2k4t s GLY 172 Ca -0.07 -0.05 0.01 0.00 0.00 0.00 0.00 44.72 44.60 2k4t s GLY 172 CO -0.00 0.05 -0.10 -0.19 0.00 0.00 0.00 173.10 172.86 2k4t s TYR 173 N 0.16 1.57 -0.11 1.90 2.02 0.78 0.11 117.35 123.77 2k4t s TYR 173 Ca -0.01 -0.74 -0.04 0.00 -0.37 0.00 0.00 57.07 55.91 2k4t s TYR 173 Cb -0.03 -1.23 -0.03 0.00 -0.40 0.00 0.00 41.96 40.26 2k4t s TYR 173 CO -0.00 -0.46 0.03 -1.59 -1.57 0.00 0.00 175.55 171.95 2k4t s LYS 174 N 1.35 3.28 0.07 -0.62 -2.85 -0.76 -1.09 119.74 119.13 2k4t s LYS 174 Ca -0.01 -0.37 -0.01 0.00 -1.00 0.00 0.00 55.97 54.58 2k4t s LYS 174 Cb -0.14 -2.93 -0.04 0.00 -2.06 0.00 0.00 37.83 32.66 2k4t s LYS 174 CO -0.05 0.60 0.00 0.99 0.10 0.00 0.00 175.35 176.99 2k4t s THR 175 N -0.58 0.19 -1.24 3.79 2.01 -1.12 -4.78 115.64 113.91 2k4t s THR 175 Ca 0.10 -1.80 0.21 0.00 0.31 0.00 0.00 61.69 60.51 2k4t s THR 175 Cb -0.12 -1.62 0.28 0.00 0.01 0.00 0.00 72.50 71.05 2k4t s THR 175 CO 0.02 -0.87 1.67 0.47 -0.69 0.00 0.00 174.62 175.23 2k4t n ASP 176 N 0.06 0.00 -0.03 3.53 8.00 -1.26 -3.97 116.55 122.88 2k4t n ASP 176 Ca -0.12 0.21 -0.04 0.00 0.71 0.00 0.00 54.79 55.54 2k4t n ASP 176 Cb 0.62 -0.38 -0.01 0.00 -0.02 0.00 0.00 41.12 41.32 2k4t n ASP 176 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 2k4t n GLU 177 N -1.38 0.25 -4.12 -1.24 2.13 -1.26 -5.10 120.64 109.92 2k4t n GLU 177 Ca 0.08 0.10 -0.08 0.00 0.66 0.00 0.00 57.16 57.91 2k4t n GLU 177 Cb 0.20 -0.89 -0.10 0.00 0.27 0.00 0.00 31.44 30.92 2k4t n GLU 177 CO 0.00 0.00 0.00 -0.59 -0.41 0.00 0.00 177.13 176.13 2k4t s PHE 178 N -2.20 0.68 -0.11 4.31 -0.12 -1.25 -4.12 117.98 115.16 2k4t s PHE 178 Ca -0.14 -1.13 0.01 0.00 -0.05 0.00 0.00 56.93 55.63 2k4t s PHE 178 Cb 0.02 -0.44 -0.01 0.00 -0.63 0.00 0.00 43.02 41.96 2k4t s PHE 178 CO 0.20 -0.42 -0.15 -0.65 -0.05 0.00 0.00 175.22 174.15 2k4t s GLN 179 N -3.97 3.19 -0.01 1.99 -0.21 -0.53 -2.79 119.66 117.34 2k4t s GLN 179 Ca 0.14 -0.71 0.06 0.00 0.02 0.00 0.00 55.36 54.86 2k4t s GLN 179 Cb 0.08 -2.55 -0.03 0.00 1.00 0.00 0.00 33.01 31.51 2k4t s GLN 179 CO -0.05 0.28 -0.17 -1.17 -2.12 0.00 0.00 175.29 172.06 2k4t s LEU 180 N 0.16 2.61 -0.07 2.90 0.20 -0.25 -0.44 118.68 123.80 2k4t s LEU 180 Ca -0.08 -0.32 -0.02 0.00 0.69 0.00 0.00 54.13 54.40 2k4t s LEU 180 Cb -0.15 -1.52 0.03 0.00 -0.43 0.00 0.00 46.19 44.12 2k4t s LEU 180 CO 0.05 0.31 0.03 -2.28 -0.29 0.00 0.00 176.35 174.16 2k4t s HIS 181 N -0.80 0.45 -0.04 5.38 2.46 0.12 -0.16 115.29 122.70 2k4t s HIS 181 Ca 0.13 -0.05 0.02 0.00 0.47 0.00 0.00 55.06 55.62 2k4t s HIS 181 Cb -0.10 -0.69 -0.03 0.00 -0.13 0.00 0.00 32.58 31.62 2k4t s HIS 181 CO 0.02 -0.30 -0.06 0.99 -2.47 0.00 0.00 174.74 172.92 2k4t s THR 182 N 2.04 3.73 -0.08 0.89 2.01 0.39 -0.59 115.64 124.04 2k4t s THR 182 Ca 0.05 -0.57 -0.05 0.00 0.31 0.00 0.00 61.69 61.42 2k4t s THR 182 Cb -0.12 -2.56 0.03 0.00 0.01 0.00 0.00 72.50 69.85 2k4t s THR 182 CO -0.05 0.52 0.19 0.21 -0.69 0.00 0.00 174.62 174.81 2k4t s ASN 183 N -1.05 -0.19 0.03 3.53 3.84 0.70 -0.06 114.94 121.74 2k4t s ASN 183 Ca 0.14 0.39 0.03 0.00 0.21 0.00 0.00 52.86 53.64 2k4t s ASN 183 Cb -0.11 0.33 -0.02 0.00 -0.55 0.00 0.00 41.25 40.90 2k4t s ASN 183 CO 0.04 -0.11 -0.11 0.68 -2.79 0.00 0.00 177.10 174.81 2k4t s VAL 184 N 0.71 0.81 -0.21 -5.21 -7.23 -0.01 -0.71 120.40 108.55 2k4t s VAL 184 Ca -0.05 -0.88 0.01 0.00 -1.81 0.00 0.00 61.98 59.25 2k4t s VAL 184 Cb -0.07 -0.77 0.03 0.00 0.56 0.00 0.00 36.38 36.13 2k4t s VAL 184 CO -0.04 -0.09 -0.16 0.20 -0.31 0.00 0.00 175.10 174.70 2k4t s ASN 185 N -1.08 3.59 -1.91 4.85 0.01 -1.14 -1.25 114.94 118.01 2k4t s ASN 185 Ca -0.02 -0.80 0.00 0.00 -0.71 0.00 0.00 52.86 51.33 2k4t s ASN 185 Cb -0.07 -1.53 0.00 0.00 0.41 0.00 0.00 41.25 40.05 2k4t s ASN 185 CO 0.01 -0.05 0.00 0.47 -1.51 0.00 0.00 177.10 176.02 2k4t n ASP 186 N 4.60 -5.30 -2.29 -1.22 8.00 0.90 -1.74 116.55 119.50 2k4t n ASP 186 Ca -0.19 0.30 -0.12 0.00 0.71 0.00 0.00 54.79 55.48 2k4t n ASP 186 Cb 0.48 -4.60 -0.01 0.00 -0.02 0.00 0.00 41.12 36.97 2k4t n ASP 186 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2k4t n GLY 187 N -0.61 -0.26 0.05 0.44 0.00 -1.26 -4.78 105.19 98.77 2k4t n GLY 187 Ca -0.21 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.76 2k4t n GLY 187 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2k4t n THR 188 N -3.18 0.63 -3.94 2.61 -1.04 -0.71 -4.95 114.28 103.70 2k4t n THR 188 Ca -0.15 -0.38 -0.29 0.00 -2.04 0.00 0.00 64.05 61.19 2k4t n THR 188 Cb 0.58 -0.76 -0.16 0.00 -1.82 0.00 0.00 70.33 68.17 2k4t n THR 188 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 2k4t s GLU 189 N -2.22 1.70 -0.20 -2.82 2.12 -1.22 -1.13 118.70 114.92 2k4t s GLU 189 Ca -0.05 -0.67 -0.15 0.00 0.36 0.00 0.00 54.97 54.46 2k4t s GLU 189 Cb 0.03 -2.20 -0.04 0.00 0.26 0.00 0.00 34.13 32.18 2k4t s GLU 189 CO 0.37 -0.43 0.36 0.12 -0.54 0.00 0.00 175.26 175.14 2k4t s PHE 190 N 1.53 3.37 0.03 5.30 2.19 0.21 -2.88 117.98 127.73 2k4t s PHE 190 Ca -0.00 0.56 0.06 0.00 0.33 0.00 0.00 56.93 57.88 2k4t s PHE 190 Cb -0.16 -2.48 -0.02 0.00 -1.31 0.00 0.00 43.02 39.05 2k4t s PHE 190 CO -0.08 0.01 -0.17 0.20 1.83 0.00 0.00 175.22 177.01 2k4t s GLY 191 N 1.02 0.91 -0.00 13.12 0.00 0.12 0.01 107.32 122.50 2k4t s GLY 191 Ca 0.17 -0.89 -0.09 0.00 0.00 0.00 0.00 44.72 43.92 2k4t s GLY 191 CO 0.07 -0.83 0.18 -0.32 0.00 0.00 0.00 173.10 172.20 2k4t s GLY 192 N -1.01 -0.00 -0.06 0.20 0.00 -0.61 -0.22 107.32 105.62 2k4t s GLY 192 Ca 0.05 -0.01 -0.04 0.00 0.00 0.00 0.00 44.72 44.72 2k4t s GLY 192 CO 0.01 -0.17 0.15 -1.35 0.00 0.00 0.00 173.10 171.74 2k4t s SER 193 N -1.33 -0.13 -0.10 1.64 1.04 0.24 -0.83 113.70 114.23 2k4t s SER 193 Ca -0.14 0.30 0.02 0.00 0.48 0.00 0.00 55.95 56.61 2k4t s SER 193 Cb -0.07 0.23 0.01 0.00 0.10 0.00 0.00 66.02 66.30 2k4t s SER 193 CO 0.02 -0.11 -0.15 0.27 0.98 0.00 0.00 173.24 174.25 2k4t s ILE 194 N 0.74 1.43 -0.20 -1.02 -0.00 0.90 0.11 121.20 123.17 2k4t s ILE 194 Ca -0.06 -0.62 -0.03 0.00 -0.00 0.00 0.00 60.65 59.95 2k4t s ILE 194 Cb -0.07 -1.30 -0.01 0.00 -0.00 0.00 0.00 42.46 41.07 2k4t s ILE 194 CO -0.04 0.43 -0.06 -0.31 -0.00 0.00 0.00 174.94 174.96 2k4t s TYR 195 N 0.87 2.94 -0.13 1.37 2.02 0.42 -1.21 117.35 123.63 2k4t s TYR 195 Ca -0.09 -0.79 0.01 0.00 -0.37 0.00 0.00 57.07 55.82 2k4t s TYR 195 Cb -0.15 -2.04 -0.01 0.00 -0.40 0.00 0.00 41.96 39.36 2k4t s TYR 195 CO 0.01 -0.42 -0.16 1.14 -1.57 0.00 0.00 175.55 174.56 2k4t s GLN 196 N 1.13 3.29 -0.14 -0.62 -2.07 0.28 -1.45 119.66 120.08 2k4t s GLN 196 Ca 0.01 -0.74 -0.17 0.00 -1.82 0.00 0.00 55.36 52.65 2k4t s GLN 196 Cb -0.15 -2.57 -0.04 0.00 -1.09 0.00 0.00 33.01 29.16 2k4t s GLN 196 CO -0.01 0.16 0.44 -1.59 -1.32 0.00 0.00 175.29 172.98 2k4t s LYS 197 N 0.46 4.31 0.00 9.60 0.00 -1.26 -1.30 119.74 131.54 2k4t s LYS 197 Ca -0.11 0.37 0.00 0.00 0.00 0.00 0.00 55.97 56.23 2k4t s LYS 197 Cb -0.16 -3.45 0.00 0.00 0.00 0.00 0.00 37.83 34.22 2k4t s LYS 197 CO 0.05 0.13 0.00 0.28 0.00 0.00 0.00 175.35 175.81 2k4t n VAL 198 N 3.77 0.00 -0.82 1.79 0.31 -0.67 -4.95 118.33 117.76 2k4t n VAL 198 Ca -0.08 0.00 -0.34 0.00 -0.01 0.00 0.00 64.34 63.91 2k4t n VAL 198 Cb 0.51 -0.58 0.11 0.00 -0.91 0.00 0.00 33.84 32.98 2k4t n VAL 198 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2k4t n ASN 199 N -1.85 -3.01 -4.59 4.52 3.02 -1.25 -4.63 115.26 107.47 2k4t n ASN 199 Ca 0.00 0.11 -0.46 0.00 -0.03 0.00 0.00 54.58 54.20 2k4t n ASN 199 Cb 0.00 -0.95 -0.02 0.00 -0.61 0.00 0.00 39.78 38.20 2k4t n ASN 199 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2k4t n LYS 200 N -0.48 1.33 -2.92 3.52 4.76 -1.26 -1.34 118.16 121.76 2k4t n LYS 200 Ca 0.02 0.47 -0.19 0.00 -2.87 0.00 0.00 58.31 55.73 2k4t n LYS 200 Cb 0.60 -1.88 0.03 0.00 -1.84 0.00 0.00 35.03 31.94 2k4t n LYS 200 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2k4t n LYS 201 N 1.09 -4.29 -3.23 1.97 5.02 -1.26 -4.98 118.16 112.48 2k4t n LYS 201 Ca 0.11 0.79 0.01 0.00 -2.02 0.00 0.00 58.31 57.20 2k4t n LYS 201 Cb 0.30 -5.39 -0.02 0.00 -0.02 0.00 0.00 35.03 29.90 2k4t n LYS 201 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2k4t s LEU 202 N -5.83 -1.24 0.02 -0.35 1.43 -0.45 -3.69 118.68 108.58 2k4t s LEU 202 Ca 0.27 0.84 0.04 0.00 -1.03 0.00 0.00 54.13 54.24 2k4t s LEU 202 Cb -0.12 2.00 -0.02 0.00 0.03 0.00 0.00 46.19 48.09 2k4t s LEU 202 CO 0.33 -0.26 -0.12 -1.61 0.23 0.00 0.00 176.35 174.92 2k4t s GLU 203 N 2.81 0.82 0.04 1.70 2.02 -0.24 -1.67 118.70 124.18 2k4t s GLU 203 Ca 0.17 -0.61 0.06 0.00 0.02 0.00 0.00 54.97 54.60 2k4t s GLU 203 Cb -0.15 -0.79 -0.02 0.00 0.10 0.00 0.00 34.13 33.27 2k4t s GLU 203 CO -0.20 0.20 -0.16 0.99 0.02 0.00 0.00 175.26 176.11 2k4t s THR 204 N -0.70 1.27 -0.06 3.63 2.01 -0.42 -1.11 115.64 120.26 2k4t s THR 204 Ca 0.01 -1.03 -0.13 0.00 0.31 0.00 0.00 61.69 60.85 2k4t s THR 204 Cb -0.07 -1.13 0.03 0.00 0.01 0.00 0.00 72.50 71.34 2k4t s THR 204 CO 0.01 0.08 0.30 0.00 -0.69 0.00 0.00 174.62 174.32 2k4t s ALA 205 N -0.80 -0.75 -0.02 7.40 0.00 0.89 -0.55 121.76 127.93 2k4t s ALA 205 Ca 0.04 0.56 -0.09 0.00 0.00 0.00 0.00 51.96 52.47 2k4t s ALA 205 Cb -0.08 -0.20 0.01 0.00 0.00 0.00 0.00 23.12 22.85 2k4t s ALA 205 CO 0.01 -0.21 0.18 0.54 0.00 0.00 0.00 175.76 176.29 2k4t s VAL 206 N -0.63 0.06 -0.05 0.00 0.11 -0.35 -0.65 120.40 118.90 2k4t s VAL 206 Ca -0.07 -0.50 -0.09 0.00 -2.93 0.00 0.00 61.98 58.39 2k4t s VAL 206 Cb -0.04 -0.43 0.02 0.00 -1.53 0.00 0.00 36.38 34.39 2k4t s VAL 206 CO 0.02 -0.28 0.21 0.54 -3.33 0.00 0.00 175.10 172.26 2k4t s ASN 207 N -1.05 -0.14 0.15 3.54 2.20 0.01 -0.07 114.94 119.57 2k4t s ASN 207 Ca -0.11 0.19 0.05 0.00 -0.94 0.00 0.00 52.86 52.04 2k4t s ASN 207 Cb -0.06 0.36 -0.04 0.00 -2.00 0.00 0.00 41.25 39.50 2k4t s ASN 207 CO 0.02 -0.23 -0.11 -1.48 -2.94 0.00 0.00 177.10 172.36 2k4t s LEU 208 N -0.58 2.51 0.03 3.54 -0.00 -0.01 -1.47 118.68 122.72 2k4t s LEU 208 Ca -0.07 -0.98 0.02 0.00 -0.00 0.00 0.00 54.13 53.11 2k4t s LEU 208 Cb -0.04 -0.42 -0.02 0.00 -0.00 0.00 0.00 46.19 45.71 2k4t s LEU 208 CO 0.01 -0.28 -0.08 0.00 -0.00 0.00 0.00 176.35 176.00 2k4t s ALA 209 N -3.08 0.63 -0.08 1.48 0.00 0.83 -1.57 121.76 119.98 2k4t s ALA 209 Ca 0.16 -0.64 -0.01 0.00 0.00 0.00 0.00 51.96 51.46 2k4t s ALA 209 Cb 0.01 -0.03 0.03 0.00 0.00 0.00 0.00 23.12 23.13 2k4t s ALA 209 CO 0.02 0.05 -0.01 -0.46 0.00 0.00 0.00 175.76 175.36 2k4t s TRP 210 N -0.99 0.76 -0.22 0.00 -0.11 0.10 -1.54 118.94 116.94 2k4t s TRP 210 Ca -0.05 -0.23 -0.09 0.00 1.22 0.00 0.00 56.10 56.94 2k4t s TRP 210 Cb -0.08 -0.85 -0.05 0.00 -1.50 0.00 0.00 33.47 31.00 2k4t s TRP 210 CO 0.00 -0.35 0.12 0.95 -4.62 0.00 0.00 176.95 173.06 2k4t s THR 211 N 1.94 5.15 -0.61 5.86 -4.23 -1.26 -0.62 115.64 121.87 2k4t s THR 211 Ca 0.05 0.10 -0.31 0.00 -1.18 0.00 0.00 61.69 60.35 2k4t s THR 211 Cb -0.12 -3.38 -0.14 0.00 1.34 0.00 0.00 72.50 70.20 2k4t s THR 211 CO -0.06 0.39 2.43 0.00 -0.54 0.00 0.00 174.62 176.84 2k4t n ALA 212 N 4.02 0.69 0.00 3.99 0.00 -0.28 -0.54 120.51 128.38 2k4t n ALA 212 Ca -0.16 -0.39 0.00 0.00 0.00 0.00 0.00 53.44 52.90 2k4t n ALA 212 Cb 0.52 -2.63 0.00 0.00 0.00 0.00 0.00 19.45 17.34 2k4t n ALA 212 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k4t n GLY 213 N 6.42 1.50 2.35 0.00 0.00 -1.26 -5.07 105.19 109.13 2k4t n GLY 213 Ca 0.49 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.35 2k4t n GLY 213 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2k4t n ASN 214 N 0.00 0.45 0.00 1.61 4.13 0.29 -5.06 115.26 116.69 2k4t n ASN 214 Ca 0.00 -1.50 0.00 0.00 1.68 0.00 0.00 54.58 54.76 2k4t n ASN 214 Cb 0.00 -0.50 0.00 0.00 -1.54 0.00 0.00 39.78 37.74 2k4t n ASN 214 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 2k4t n SER 215 N -3.22 2.71 -4.85 6.41 3.41 -1.26 -4.96 113.62 111.85 2k4t n SER 215 Ca 0.10 0.00 -0.37 0.00 -0.26 0.00 0.00 58.87 58.34 2k4t n SER 215 Cb 0.36 0.09 -0.06 0.00 -0.26 0.00 0.00 64.21 64.33 2k4t n SER 215 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 2k4t s ASN 216 N -3.25 6.48 -0.05 4.04 0.02 -1.26 -5.10 114.94 115.82 2k4t s ASN 216 Ca 0.00 0.58 0.03 0.00 -1.02 0.00 0.00 52.86 52.44 2k4t s ASN 216 Cb 0.00 -2.12 -0.03 0.00 0.02 0.00 0.00 41.25 39.12 2k4t s ASN 216 CO 0.00 0.36 -0.13 0.28 0.02 0.00 0.00 177.10 177.63 2k4t s THR 217 N -0.86 3.22 -0.08 1.60 -1.32 -1.26 -4.83 115.64 112.10 2k4t s THR 217 Ca 0.17 -0.66 -0.32 0.00 -1.21 0.00 0.00 61.69 59.66 2k4t s THR 217 Cb -0.13 -2.27 0.13 0.00 -1.51 0.00 0.00 72.50 68.72 2k4t s THR 217 CO 0.06 0.59 1.40 0.00 -2.21 0.00 0.00 174.62 174.47 2k4t s ARG 218 N -0.73 0.08 0.23 7.08 1.70 -0.59 -4.75 118.95 121.97 2k4t s ARG 218 Ca 0.11 -0.05 0.00 0.00 -0.47 0.00 0.00 55.73 55.33 2k4t s ARG 218 Cb -0.11 0.03 0.00 0.00 -0.57 0.00 0.00 34.95 34.30 2k4t s ARG 218 CO 0.01 -0.04 0.00 0.34 -1.08 0.00 0.00 175.30 174.53 2k4t n PHE 219 N -0.61 -3.56 0.00 5.89 -0.00 -1.13 -0.12 117.46 117.94 2k4t n PHE 219 Ca -0.06 0.81 0.00 0.00 -0.00 0.00 0.00 57.45 58.20 2k4t n PHE 219 Cb 0.62 2.25 0.00 0.00 -0.00 0.00 0.00 39.48 42.35 2k4t n PHE 219 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2k4t n GLY 220 N -1.49 0.46 3.09 7.13 0.00 -0.54 -0.46 105.19 113.38 2k4t n GLY 220 Ca 0.00 -1.04 -0.11 0.00 0.00 0.00 0.00 46.02 44.87 2k4t n GLY 220 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2k4t s ILE 221 N -2.00 0.50 0.06 -0.61 -5.25 0.07 -0.81 121.20 113.15 2k4t s ILE 221 Ca 0.00 -1.39 0.01 0.00 -0.99 0.00 0.00 60.65 58.27 2k4t s ILE 221 Cb 0.00 -0.99 -0.03 0.00 2.95 0.00 0.00 42.46 44.39 2k4t s ILE 221 CO 0.00 -0.61 -0.05 0.00 -1.79 0.00 0.00 174.94 172.49 2k4t s ALA 222 N -2.34 0.61 0.02 2.27 0.00 0.18 -0.75 121.76 121.75 2k4t s ALA 222 Ca -0.02 -1.05 -0.06 0.00 0.00 0.00 0.00 51.96 50.83 2k4t s ALA 222 Cb -0.03 0.16 -0.01 0.00 0.00 0.00 0.00 23.12 23.24 2k4t s ALA 222 CO -0.02 -0.21 0.10 0.00 0.00 0.00 0.00 175.76 175.63 2k4t s ALA 223 N -2.82 -0.17 -0.09 0.00 0.00 0.59 -0.07 121.76 119.19 2k4t s ALA 223 Ca 0.01 -0.35 0.04 0.00 0.00 0.00 0.00 51.96 51.65 2k4t s ALA 223 Cb -0.00 0.17 0.00 0.00 0.00 0.00 0.00 23.12 23.30 2k4t s ALA 223 CO -0.04 -0.25 -0.20 0.21 0.00 0.00 0.00 175.76 175.47 2k4t s LYS 224 N -1.89 2.59 -0.02 0.00 2.47 -0.26 -0.91 119.74 121.72 2k4t s LYS 224 Ca -0.11 -0.74 0.02 0.00 -1.56 0.00 0.00 55.97 53.58 2k4t s LYS 224 Cb -0.05 -2.01 0.00 0.00 -1.46 0.00 0.00 37.83 34.31 2k4t s LYS 224 CO -0.01 0.15 -0.06 -0.47 0.16 0.00 0.00 175.35 175.12 2k4t s TYR 225 N 0.40 0.60 -0.14 4.03 5.04 0.82 -1.08 117.35 127.02 2k4t s TYR 225 Ca -0.16 -0.12 -0.02 0.00 -2.44 0.00 0.00 57.07 54.32 2k4t s TYR 225 Cb -0.17 -0.44 -0.02 0.00 0.35 0.00 0.00 41.96 41.68 2k4t s TYR 225 CO 0.07 -0.06 -0.07 -0.65 -1.34 0.00 0.00 175.55 173.51 2k4t s GLN 226 N 0.16 3.47 -0.08 4.97 -0.21 -1.24 -0.56 119.66 126.17 2k4t s GLN 226 Ca -0.02 -0.56 0.12 0.00 0.02 0.00 0.00 55.36 54.92 2k4t s GLN 226 Cb -0.06 -2.80 -0.18 0.00 1.00 0.00 0.00 33.01 30.97 2k4t s GLN 226 CO -0.00 0.30 0.15 1.51 -2.12 0.00 0.00 175.29 175.12 2k4t n ILE 227 N 3.34 0.51 -4.11 1.08 0.00 -1.26 -4.93 119.36 114.01 2k4t n ILE 227 Ca -0.18 -0.44 -0.08 0.00 0.00 0.00 0.00 62.75 62.05 2k4t n ILE 227 Cb 0.53 -0.32 -0.10 0.00 0.00 0.00 0.00 39.64 39.75 2k4t n ILE 227 CO 0.00 0.00 0.00 -1.81 0.00 0.00 0.00 176.55 174.74 2k4t s ASP 228 N -4.15 0.53 0.00 9.51 1.01 -1.20 -5.02 116.67 117.35 2k4t s ASP 228 Ca -0.06 -1.03 0.14 0.00 0.71 0.00 0.00 52.55 52.31 2k4t s ASP 228 Cb 0.06 0.20 0.65 0.00 1.01 0.00 0.00 42.92 44.85 2k4t s ASP 228 CO 0.54 -0.61 1.44 -0.81 0.21 0.00 0.00 175.17 175.94 2k4t n PRO 229 N 0.06 0.07 0.00 8.23 -0.04 -1.26 -3.30 135.00 138.77 2k4t n PRO 229 Ca -0.13 0.22 0.00 0.00 -0.04 0.00 0.00 63.50 63.55 2k4t n PRO 229 Cb 0.61 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.57 2k4t n PRO 229 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2k4t n ASP 230 N -1.42 4.19 -4.87 3.54 8.00 -1.26 -5.05 116.55 119.68 2k4t n ASP 230 Ca 0.05 0.00 -0.35 0.00 0.71 0.00 0.00 54.79 55.20 2k4t n ASP 230 Cb 0.15 0.29 -0.05 0.00 -0.02 0.00 0.00 41.12 41.48 2k4t n ASP 230 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2k4t s ALA 231 N -1.90 3.72 0.03 2.24 0.00 -1.21 -4.09 121.76 120.55 2k4t s ALA 231 Ca 0.00 -0.37 0.04 0.00 0.00 0.00 0.00 51.96 51.62 2k4t s ALA 231 Cb 0.00 -2.28 -0.02 0.00 0.00 0.00 0.00 23.12 20.83 2k4t s ALA 231 CO 0.00 0.56 -0.11 0.00 0.00 0.00 0.00 175.76 176.21 2k4t s PHE 233 N -0.77 2.02 0.01 0.00 5.36 0.27 -0.92 117.98 123.95 2k4t s PHE 233 Ca -0.00 -0.75 0.04 0.00 -0.96 0.00 0.00 56.93 55.26 2k4t s PHE 233 Cb -0.07 -1.38 -0.01 0.00 -0.34 0.00 0.00 43.02 41.22 2k4t s PHE 233 CO 0.01 -0.31 -0.12 0.45 -1.46 0.00 0.00 175.22 173.79 2k4t s SER 234 N 0.36 1.38 -0.02 6.13 0.15 0.06 -0.12 113.70 121.63 2k4t s SER 234 Ca -0.13 -0.28 0.03 0.00 0.70 0.00 0.00 55.95 56.27 2k4t s SER 234 Cb -0.16 -0.13 -0.00 0.00 -1.71 0.00 0.00 66.02 64.02 2k4t s SER 234 CO 0.06 0.10 -0.11 0.00 1.20 0.00 0.00 173.24 174.48 2k4t s ALA 235 N -0.46 0.98 -0.01 5.45 0.00 -0.09 -0.21 121.76 127.42 2k4t s ALA 235 Ca 0.03 -0.45 0.00 0.00 0.00 0.00 0.00 51.96 51.54 2k4t s ALA 235 Cb -0.05 -0.30 0.01 0.00 0.00 0.00 0.00 23.12 22.78 2k4t s ALA 235 CO 0.00 0.20 0.00 0.15 0.00 0.00 0.00 175.76 176.12 2k4t s LYS 236 N -0.07 0.12 0.02 0.00 1.02 0.20 -0.30 119.74 120.74 2k4t s LYS 236 Ca 0.01 0.04 0.03 0.00 0.02 0.00 0.00 55.97 56.07 2k4t s LYS 236 Cb -0.07 -0.24 -0.02 0.00 -0.52 0.00 0.00 37.83 36.98 2k4t s LYS 236 CO 0.00 -0.06 -0.09 0.14 -0.92 0.00 0.00 175.35 174.42 2k4t s VAL 237 N 0.53 0.69 -0.07 3.17 -7.23 0.07 0.10 120.40 117.66 2k4t s VAL 237 Ca -0.05 -0.77 0.03 0.00 -1.81 0.00 0.00 61.98 59.39 2k4t s VAL 237 Cb -0.07 -0.66 -0.02 0.00 0.56 0.00 0.00 36.38 36.19 2k4t s VAL 237 CO -0.01 -0.08 -0.16 0.21 -0.31 0.00 0.00 175.10 174.75 2k4t s ASN 238 N -0.94 3.85 -0.88 4.85 3.84 -0.56 -0.75 114.94 124.35 2k4t s ASN 238 Ca -0.02 -0.28 0.00 0.00 0.21 0.00 0.00 52.86 52.76 2k4t s ASN 238 Cb -0.07 -1.02 0.00 0.00 -0.55 0.00 0.00 41.25 39.61 2k4t s ASN 238 CO 0.00 0.28 0.00 0.59 -2.79 0.00 0.00 177.10 175.19 2k4t n ASN 239 N 2.72 -2.47 -0.89 -4.21 4.13 0.39 -0.18 115.26 114.74 2k4t n ASN 239 Ca -0.17 0.23 -0.09 0.00 1.68 0.00 0.00 54.58 56.23 2k4t n ASN 239 Cb 0.52 -2.39 -0.04 0.00 -1.54 0.00 0.00 39.78 36.33 2k4t n ASN 239 CO 0.00 0.00 0.00 -0.24 0.28 0.00 0.00 177.26 177.30 2k4t n SER 240 N -0.40 -4.02 -0.11 6.41 2.88 -1.26 -4.72 113.62 112.39 2k4t n SER 240 Ca -0.09 0.23 -0.15 0.00 -1.33 0.00 0.00 58.87 57.52 2k4t n SER 240 Cb 0.36 -3.22 -0.10 0.00 -0.75 0.00 0.00 64.21 60.49 2k4t n SER 240 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2k4t n SER 241 N -0.36 2.28 -4.60 -3.46 2.88 0.74 -4.98 113.62 106.13 2k4t n SER 241 Ca -0.09 -0.11 -0.34 0.00 -1.33 0.00 0.00 58.87 57.00 2k4t n SER 241 Cb 0.44 -0.35 -0.11 0.00 -0.75 0.00 0.00 64.21 63.43 2k4t n SER 241 CO 0.00 0.00 0.00 -0.22 -1.23 0.00 0.00 175.04 173.59 2k4t s LEU 242 N -6.31 3.22 0.05 2.46 2.96 -0.94 -1.64 118.68 118.49 2k4t s LEU 242 Ca -0.30 -0.03 0.08 0.00 -0.22 0.00 0.00 54.13 53.67 2k4t s LEU 242 Cb 0.08 -1.74 -0.03 0.00 0.50 0.00 0.00 46.19 45.00 2k4t s LEU 242 CO 0.50 0.35 -0.22 0.27 -1.32 0.00 0.00 176.35 175.93 2k4t s ILE 243 N -0.86 1.78 -0.04 6.68 -0.00 -0.60 -1.49 121.20 126.66 2k4t s ILE 243 Ca 0.14 -1.28 -0.02 0.00 -0.00 0.00 0.00 60.65 59.49 2k4t s ILE 243 Cb -0.11 -1.55 0.03 0.00 -0.00 0.00 0.00 42.46 40.84 2k4t s ILE 243 CO 0.03 0.21 0.08 -0.83 -0.00 0.00 0.00 174.94 174.43 2k4t s GLY 244 N -1.28 0.10 -0.13 6.27 0.00 0.11 -0.91 107.32 111.48 2k4t s GLY 244 Ca 0.08 0.39 -0.01 0.00 0.00 0.00 0.00 44.72 45.18 2k4t s GLY 244 CO 0.02 1.08 -0.11 0.48 0.00 0.00 0.00 173.10 174.57 2k4t s LEU 245 N 1.56 2.85 -0.14 0.66 2.34 0.01 -0.62 118.68 125.32 2k4t s LEU 245 Ca -0.04 -0.27 -0.04 0.00 0.06 0.00 0.00 54.13 53.84 2k4t s LEU 245 Cb -0.12 -1.65 0.06 0.00 -0.56 0.00 0.00 46.19 43.92 2k4t s LEU 245 CO -0.04 0.17 0.14 -0.83 -1.06 0.00 0.00 176.35 174.73 2k4t s GLY 246 N 0.31 0.16 0.05 -3.48 0.00 0.70 -0.06 107.32 105.00 2k4t s GLY 246 Ca -0.09 0.13 0.07 0.00 0.00 0.00 0.00 44.72 44.83 2k4t s GLY 246 CO 0.05 1.79 -0.19 -2.52 0.00 0.00 0.00 173.10 172.23 2k4t s TYR 247 N 2.23 1.64 -0.02 1.90 1.13 0.30 -0.76 117.35 123.77 2k4t s TYR 247 Ca 0.04 -0.37 0.07 0.00 -1.41 0.00 0.00 57.07 55.40 2k4t s TYR 247 Cb -0.14 -0.97 -0.02 0.00 -1.10 0.00 0.00 41.96 39.73 2k4t s TYR 247 CO -0.08 0.09 -0.23 0.95 -2.51 0.00 0.00 175.55 173.76 2k4t s THR 248 N -0.86 1.85 0.21 -3.49 -4.23 -0.10 -0.98 115.64 108.05 2k4t s THR 248 Ca 0.06 -1.01 0.08 0.00 -1.18 0.00 0.00 61.69 59.64 2k4t s THR 248 Cb -0.09 -1.54 -0.04 0.00 1.34 0.00 0.00 72.50 72.18 2k4t s THR 248 CO 0.02 0.52 0.02 -1.58 -0.54 0.00 0.00 174.62 173.05 2k4t s GLN 249 N -0.57 2.43 -0.00 3.99 0.74 -0.15 -1.32 119.66 124.77 2k4t s GLN 249 Ca 0.09 -1.19 -0.29 0.00 0.05 0.00 0.00 55.36 54.02 2k4t s GLN 249 Cb -0.09 -2.32 0.11 0.00 1.10 0.00 0.00 33.01 31.80 2k4t s GLN 249 CO -0.01 0.42 1.27 -0.08 -0.55 0.00 0.00 175.29 176.35 2k4t s THR 250 N -1.94 0.00 0.00 -0.34 -1.32 -1.26 -1.21 115.64 109.57 2k4t s THR 250 Ca 0.29 -0.22 0.00 0.00 -1.21 0.00 0.00 61.69 60.55 2k4t s THR 250 Cb -0.08 -2.48 0.00 0.00 -1.51 0.00 0.00 72.50 68.43 2k4t s THR 250 CO 0.20 0.00 0.00 -0.11 -2.21 0.00 0.00 174.62 172.50 2k4t n LEU 251 N -0.69 0.00 0.13 9.08 7.94 -1.26 -4.50 117.00 127.71 2k4t n LEU 251 Ca -0.03 0.00 -0.06 0.00 -1.11 0.00 0.00 56.01 54.81 2k4t n LEU 251 Cb 0.61 0.00 -0.03 0.00 0.53 0.00 0.00 43.42 44.53 2k4t n LEU 251 CO 0.14 -0.14 0.19 0.11 -1.11 0.00 0.00 177.39 176.57 2k4t h LYS 252 N 0.00 -0.38 0.00 1.96 1.57 -2.00 -3.47 116.57 114.25 2k4t h LYS 252 Ca 0.00 0.03 -0.14 0.00 -1.87 0.00 0.00 60.65 58.66 2k4t h LYS 252 Cb 0.00 0.09 0.07 0.00 0.08 0.00 0.00 32.23 32.47 2k4t h LYS 252 CO 0.00 -0.26 0.04 -0.35 -0.57 0.00 0.00 179.45 178.32 2k4t n PRO 253 N -4.59 -1.80 0.05 3.15 -0.04 -1.26 -4.99 135.00 125.52 2k4t n PRO 253 Ca -0.05 -0.63 0.03 0.00 -0.04 0.00 0.00 63.50 62.80 2k4t n PRO 253 Cb 0.16 -0.59 -0.06 0.00 -0.04 0.00 0.00 33.50 32.96 2k4t n PRO 253 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2k4t n GLY 254 N -0.18 -1.26 3.10 0.55 0.00 -1.26 -4.89 105.19 101.25 2k4t n GLY 254 Ca 0.05 -0.15 -0.12 0.00 0.00 0.00 0.00 46.02 45.81 2k4t n GLY 254 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2k4t s ILE 255 N -3.03 -0.10 0.05 -0.61 2.07 -1.26 -4.85 121.20 113.47 2k4t s ILE 255 Ca -0.02 0.15 -0.01 0.00 -1.41 0.00 0.00 60.65 59.36 2k4t s ILE 255 Cb 0.09 -0.45 -0.00 0.00 0.13 0.00 0.00 42.46 42.23 2k4t s ILE 255 CO 0.81 0.06 -0.02 1.17 -1.91 0.00 0.00 174.94 175.05 2k4t n LYS 256 N 4.41 0.03 -5.07 3.50 3.00 -0.35 -4.98 118.16 118.69 2k4t n LYS 256 Ca -0.22 0.01 -0.32 0.00 -0.00 0.00 0.00 58.31 57.78 2k4t n LYS 256 Cb 0.53 -0.39 -0.16 0.00 0.00 0.00 0.00 35.03 35.01 2k4t n LYS 256 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 2k4t s LEU 257 N -6.36 2.31 -0.29 3.14 1.98 -0.43 -4.00 118.68 115.03 2k4t s LEU 257 Ca -0.01 -0.46 -0.08 0.00 -2.89 0.00 0.00 54.13 50.69 2k4t s LEU 257 Cb 0.00 -1.47 0.00 0.00 0.66 0.00 0.00 46.19 45.38 2k4t s LEU 257 CO 0.02 0.18 0.10 -0.89 -1.89 0.00 0.00 176.35 173.87 2k4t s THR 258 N 0.21 4.16 -0.23 3.68 2.01 -0.45 -0.98 115.64 124.04 2k4t s THR 258 Ca -0.13 -0.57 -0.03 0.00 0.31 0.00 0.00 61.69 61.27 2k4t s THR 258 Cb -0.16 -3.12 0.01 0.00 0.01 0.00 0.00 72.50 69.23 2k4t s THR 258 CO 0.07 0.10 -0.05 -0.76 -0.69 0.00 0.00 174.62 173.29 2k4t s LEU 259 N 1.54 3.00 0.12 4.42 1.43 -0.15 -0.29 118.68 128.75 2k4t s LEU 259 Ca 0.04 -0.58 0.09 0.00 -1.03 0.00 0.00 54.13 52.65 2k4t s LEU 259 Cb -0.17 -1.71 -0.04 0.00 0.03 0.00 0.00 46.19 44.30 2k4t s LEU 259 CO 0.03 -0.06 -0.23 -0.55 0.23 0.00 0.00 176.35 175.77 2k4t s SER 260 N 1.42 2.81 -0.15 2.29 0.15 0.02 -0.54 113.70 119.69 2k4t s SER 260 Ca 0.04 -0.72 -0.09 0.00 0.70 0.00 0.00 55.95 55.87 2k4t s SER 260 Cb -0.15 -0.17 0.05 0.00 -1.71 0.00 0.00 66.02 64.05 2k4t s SER 260 CO -0.04 0.09 0.38 0.00 1.20 0.00 0.00 173.24 174.87 2k4t s ALA 261 N -1.21 -0.95 -0.15 5.45 0.00 0.91 -0.54 121.76 125.28 2k4t s ALA 261 Ca 0.10 1.37 0.01 0.00 0.00 0.00 0.00 51.96 53.44 2k4t s ALA 261 Cb -0.10 -0.83 0.00 0.00 0.00 0.00 0.00 23.12 22.19 2k4t s ALA 261 CO 0.05 -0.24 -0.18 -1.17 0.00 0.00 0.00 175.76 174.22 2k4t s LEU 262 N 1.20 2.33 -0.09 0.00 1.98 0.92 -0.81 118.68 124.22 2k4t s LEU 262 Ca -0.08 -0.52 0.04 0.00 -2.89 0.00 0.00 54.13 50.67 2k4t s LEU 262 Cb -0.08 -1.52 0.00 0.00 0.66 0.00 0.00 46.19 45.26 2k4t s LEU 262 CO -0.10 0.08 -0.21 -0.76 -1.89 0.00 0.00 176.35 173.47 2k4t s LEU 263 N 0.84 1.98 -0.60 -0.68 2.01 -0.09 -1.59 118.68 120.55 2k4t s LEU 263 Ca -0.06 -0.50 -0.20 0.00 0.01 0.00 0.00 54.13 53.39 2k4t s LEU 263 Cb -0.15 -1.27 0.09 0.00 0.01 0.00 0.00 46.19 44.87 2k4t s LEU 263 CO -0.01 0.13 0.77 -0.62 1.01 0.00 0.00 176.35 177.63 2k4t s ASP 264 N 0.43 6.19 0.00 2.29 -1.08 -1.26 -1.56 116.67 121.68 2k4t s ASP 264 Ca -0.18 -1.23 0.00 0.00 -0.52 0.00 0.00 52.55 50.62 2k4t s ASP 264 Cb -0.17 -2.33 0.00 0.00 -1.46 0.00 0.00 42.92 38.95 2k4t s ASP 264 CO 0.07 -1.18 0.00 0.61 0.52 0.00 0.00 175.17 175.19 2k4t n GLY 265 N 5.28 0.33 2.64 2.66 0.00 -0.65 -2.89 105.19 112.55 2k4t n GLY 265 Ca -0.07 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.76 2k4t n GLY 265 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2k4t n LYS 266 N -1.33 -1.51 -0.01 1.61 4.76 -1.26 -4.78 118.16 115.65 2k4t n LYS 266 Ca 0.00 1.16 0.06 0.00 -2.87 0.00 0.00 58.31 56.67 2k4t n LYS 266 Cb 0.18 -5.56 -0.10 0.00 -1.84 0.00 0.00 35.03 27.70 2k4t n LYS 266 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 2k4t n ASN 267 N -1.34 1.99 0.08 4.39 5.15 -1.14 -4.40 115.26 119.99 2k4t n ASN 267 Ca -0.19 0.00 0.09 0.00 -0.60 0.00 0.00 54.58 53.88 2k4t n ASN 267 Cb 0.67 1.58 0.38 0.00 -0.53 0.00 0.00 39.78 41.88 2k4t n ASN 267 CO 0.00 0.00 0.00 1.33 1.40 0.00 0.00 177.26 179.99 2k4t n VAL 268 N -1.97 1.07 -0.18 3.44 0.24 -1.24 -2.84 118.33 116.85 2k4t n VAL 268 Ca -0.03 0.35 0.28 0.00 -2.04 0.00 0.00 64.34 62.90 2k4t n VAL 268 Cb 0.36 -1.24 0.72 0.00 -1.47 0.00 0.00 33.84 32.21 2k4t n VAL 268 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2k4t h ASN 269 N 0.00 0.01 -0.52 -1.34 -1.07 -1.88 0.40 115.58 111.17 2k4t h ASN 269 Ca 0.00 0.00 0.14 0.00 0.07 0.00 0.00 56.30 56.51 2k4t h ASN 269 Cb 0.23 -0.00 -0.02 0.00 -2.07 0.00 0.00 38.32 36.45 2k4t h ASN 269 CO 0.00 0.00 0.37 0.00 0.07 0.00 0.00 177.43 177.87 2k4t h ALA 270 N 1.56 2.39 0.00 4.14 0.00 -1.87 -3.42 119.26 122.06 2k4t h ALA 270 Ca 0.42 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.32 2k4t h ALA 270 Cb 1.68 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.49 2k4t h ALA 270 CO -0.01 -0.54 0.00 0.41 0.00 0.00 0.00 179.25 179.11 2k4t n GLY 271 N -1.61 -1.70 0.00 0.00 0.00 0.84 -5.07 105.19 97.65 2k4t n GLY 271 Ca 0.09 0.59 0.00 0.00 0.00 0.00 0.00 46.02 46.71 2k4t n GLY 271 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k4t n GLY 272 N 0.00 0.00 3.92 -0.02 0.00 0.10 -5.07 105.19 104.13 2k4t n GLY 272 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 2k4t n GLY 272 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2k4t s HIS 273 N 0.00 3.51 0.04 1.61 -0.00 -1.19 -4.83 115.29 114.43 2k4t s HIS 273 Ca 0.00 0.57 0.05 0.00 -0.00 0.00 0.00 55.06 55.68 2k4t s HIS 273 Cb 0.00 -2.07 -0.04 0.00 -0.00 0.00 0.00 32.58 30.47 2k4t s HIS 273 CO 0.00 0.04 -0.10 0.21 -0.00 0.00 0.00 174.74 174.89 2k4t s LYS 274 N -4.15 2.33 -0.09 -0.38 2.20 -0.62 -4.69 119.74 114.34 2k4t s LYS 274 Ca 0.43 -0.86 -0.09 0.00 -0.36 0.00 0.00 55.97 55.09 2k4t s LYS 274 Cb -0.10 -2.38 0.02 0.00 -1.51 0.00 0.00 37.83 33.86 2k4t s LYS 274 CO 0.36 0.56 0.25 -0.48 -0.36 0.00 0.00 175.35 175.68 2k4t s LEU 275 N -1.66 1.05 -0.19 5.43 2.34 -1.26 -0.05 118.68 124.34 2k4t s LEU 275 Ca 0.18 0.49 0.00 0.00 0.06 0.00 0.00 54.13 54.86 2k4t s LEU 275 Cb -0.11 0.87 0.04 0.00 -0.56 0.00 0.00 46.19 46.43 2k4t s LEU 275 CO 0.09 -0.10 -0.09 -0.83 -1.06 0.00 0.00 176.35 174.36 2k4t s GLY 276 N 0.08 1.18 -0.28 -3.48 0.00 0.30 -0.88 107.32 104.24 2k4t s GLY 276 Ca -0.01 -1.09 -0.10 0.00 0.00 0.00 0.00 44.72 43.53 2k4t s GLY 276 CO 0.00 0.75 0.15 1.08 0.00 0.00 0.00 173.10 175.08 2k4t s LEU 277 N 1.46 3.89 -0.25 0.66 1.43 -0.13 -0.80 118.68 124.94 2k4t s LEU 277 Ca -0.00 -0.18 -0.05 0.00 -1.03 0.00 0.00 54.13 52.86 2k4t s LEU 277 Cb -0.16 -2.04 -0.00 0.00 0.03 0.00 0.00 46.19 44.02 2k4t s LEU 277 CO -0.08 -0.08 0.02 -0.83 0.23 0.00 0.00 176.35 175.60 2k4t s GLY 278 N 1.69 1.70 0.04 -3.19 0.00 0.60 -0.84 107.32 107.32 2k4t s GLY 278 Ca 0.06 -1.27 0.03 0.00 0.00 0.00 0.00 44.72 43.54 2k4t s GLY 278 CO 0.08 0.53 -0.01 0.48 0.00 0.00 0.00 173.10 174.18 2k4t s LEU 279 N 1.50 3.45 -0.30 0.66 2.34 -0.25 -1.34 118.68 124.75 2k4t s LEU 279 Ca 0.04 -0.09 -0.15 0.00 0.06 0.00 0.00 54.13 53.99 2k4t s LEU 279 Cb -0.16 -2.07 0.18 0.00 -0.56 0.00 0.00 46.19 43.58 2k4t s LEU 279 CO -0.00 0.24 1.15 -0.70 -1.06 0.00 0.00 176.35 175.98 2k4t s GLU 280 N -1.85 0.06 0.02 1.48 2.12 -1.26 -1.50 118.70 117.77 2k4t s GLU 280 Ca 0.22 0.08 0.00 0.00 0.36 0.00 0.00 54.97 55.63 2k4t s GLU 280 Cb -0.12 0.04 0.00 0.00 0.26 0.00 0.00 34.13 34.32 2k4t s GLU 280 CO 0.13 -0.10 0.00 1.19 -0.54 0.00 0.00 175.26 175.94 2k4t n PHE 281 N 5.20 -0.08 -4.09 5.30 3.72 -1.26 -4.78 117.46 121.46 2k4t n PHE 281 Ca 0.04 0.01 -0.10 0.00 -0.05 0.00 0.00 57.45 57.35 2k4t n PHE 281 Cb 0.57 0.16 -0.11 0.00 -0.94 0.00 0.00 39.48 39.17 2k4t n PHE 281 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 2k4t s GLN 282 N -1.10 0.62 -0.37 -1.08 -0.21 -1.26 -4.97 119.66 111.29 2k4t s GLN 282 Ca 0.00 -1.04 -0.07 0.00 0.02 0.00 0.00 55.36 54.27 2k4t s GLN 282 Cb 0.00 -0.08 0.06 0.00 1.00 0.00 0.00 33.01 33.98 2k4t s GLN 282 CO 0.00 -0.03 0.15 0.00 -2.12 0.00 0.00 175.29 173.30 2k4t s ALA 283 N -2.75 3.12 -0.52 6.09 0.00 -1.25 -4.80 121.76 121.65 2k4t s ALA 283 Ca 0.00 -1.93 -0.31 0.00 0.00 0.00 0.00 51.96 49.73 2k4t s ALA 283 Cb -0.01 -2.38 -0.11 0.00 0.00 0.00 0.00 23.12 20.62 2k4t s ALA 283 CO -0.04 -1.46 2.37 -0.11 0.00 0.00 0.00 175.76 176.52 2k4t n LEU 284 N 4.82 1.91 -0.15 0.00 7.94 -1.26 -4.78 117.00 125.48 2k4t n LEU 284 Ca -0.11 0.03 0.15 0.00 -1.11 0.00 0.00 56.01 54.97 2k4t n LEU 284 Cb 0.44 -1.33 0.81 0.00 0.53 0.00 0.00 43.42 43.87 2k4t n LEU 284 CO 0.34 -1.02 1.03 -1.84 -1.11 0.00 0.00 177.39 174.79